Hydrochloric Acid → 2-[[3-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-7-(2,5-dimethyl-1,3-oxazole-4-carbonyl)-3,6,8,9-tetrahydro-2H-[1,4]dioxino[2,3-g]isoquinoline-8-carbonyl]amino]-3-[4-(2,3-dimethyl-4-pyridinyl)phenyl]propanoic acid

HRID 2328912Notizen

Reaktionsgleichung

Reaktionsgleichung von HRID 2328912
[CH3:3][O:4][C:5](=[O:6])[CH:7]([NH:8][C:9]([CH:10]1[CH2:11][c:12]2[cH:13][c:14]3[c:35]([cH:36][c:37]2[CH2:38][NH:39]1)[O:34][CH:17]([c:18]1[cH:19][cH:20][c:21]([O:22][CH2:23][c:24]2[cH:25][cH:26][c:27]([Cl:28])[c:29]([Cl:30])[cH:31]2)[cH:32][cH:33]1)[CH2:16][O:15]3)=[O:40])[CH2:41][c:42]1[cH:43][cH:44][c:45](-[c:46]2[cH:47][cH:48][n:49][c:50]([CH3:51])[c:52]2[CH3:53])[cH:54][cH:55]1.[CH3:56][O:57][C:58]([CH:59]([CH2:60][c:61]1[cH:62][cH:63][c:64](-[c:67]2[c:68]([CH3:74])[c:69]([CH3:73])[n:70][cH:71][cH:72]2)[cH:65][cH:66]1)[NH:75][C:76](=[O:77])[CH:78]1[N:79]([C:108](=[O:109])[c:110]2[n:111][c:112]([CH3:116])[o:113][c:114]2[CH3:115])[CH2:80][c:81]2[cH:82][c:83]3[c:84]([cH:85][c:86]2[CH2:87]1)[O:88][CH2:89][CH:90]([c:92]1[cH:93][cH:94][c:95]([O:98][CH2:99][c:100]2[cH:101][c:102]([Cl:107])[c:103]([Cl:106])[cH:104][cH:105]2)[cH:96][cH:97]1)[O:91]3)=[O:117].[ClH:1].[ClH:2]>>[O:57]=[C:58]([CH:59]([CH2:60][c:61]1[cH:62][cH:63][c:64](-[c:67]2[c:68]([CH3:74])[c:69]([CH3:73])[n:70][cH:71][cH:72]2)[cH:65][cH:66]1)[NH:75][C:76](=[O:77])[CH:78]1[N:79]([C:108](=[O:109])[c:110]2[n:111][c:112]([CH3:116])[o:113][c:114]2[CH3:115])[CH2:80][c:81]2[cH:82][c:83]3[c:84]([cH:85][c:86]2[CH2:87]1)[O:88][CH2:89][CH:90]([c:92]1[cH:93][cH:94][c:95]([O:98][CH2:99][c:100]2[cH:101][c:102]([Cl:107])[c:103]([Cl:106])[cH:104][cH:105]2)[cH:96][cH:97]1)[O:91]3)[OH:117]

Komponenten

4

Edukt 3

HCID 313Hydrochloric Acid2×HCID 76761787Methyl 2-[[3-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-2,3,6,7,8,9-hexahydro-[1,4]dioxino[2,3-g]isoquinoline-8-carbonyl]amino]-3-[4-(2,3-dimethyl-4-pyridinyl)phenyl]propanoateHCID 178499762methyl 2-[[3-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-7-(2,5-dimethyl-1,3-oxazole-4-carbonyl)-3,6,8,9-tetrahydro-2H-[1,4]dioxino[2,3-g]isoquinoline-8-carbonyl]amino]-3-[4-(2,3-dimethyl-4-pyridinyl)phenyl]propanoate

Produkt 1

HCID 1784329882-[[3-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-7-(2,5-dimethyl-1,3-oxazole-4-carbonyl)-3,6,8,9-tetrahydro-2H-[1,4]dioxino[2,3-g]isoquinoline-8-carbonyl]amino]-3-[4-(2,3-dimethyl-4-pyridinyl)phenyl]propanoic acid

Quellen und Nachweise

ORD-Eintrag
ord-1fda864ff0b24d22abe2602b695dde2a
Quelldatensatz
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Notizen zur Reaktion

Wird geladen…