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Benzamide, N-(1,2,3,4-tetrahydro-2-methylisoquinolin-7-yl)-3,4,5-trimethoxy-

HCID 216591
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Basic information

CAS
37481-34-8
Standard SMILES
COc1cc(C(=O)Nc2ccc3c(c2)CN(C)CC3)cc(OC)c1OC
InChIKey
AHONRCXNXUBHGE-UHFFFAOYSA-N
Molecular formula
C20H24N2O4
Average molar mass
356.4 g/mol
Monoisotopic mass
356.17360725

Names & identifiers

Preferred name
Benzamide, N-(1,2,3,4-tetrahydro-2-methylisoquinolin-7-yl)-3,4,5-trimethoxy-
IUPAC
3,4,5-trimethoxy-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide
English name
3,4,5-Trimethoxy-N-(1,2,3,4-tetrahydro-2-methylisoquinolin-7-yl)benzamide
Molecular formula
C20H24N2O4
Molecular weight
356.42

Names & synonyms

37481-34-8BRN 0449623Benzamide, N-(1,2,3,4-tetrahydro-2-methylisoquinolin-7-yl)-3,4,5-trimethoxy-DTXSID701909225-22-09-00474 (Beilstein Handbook Reference)Isoquinoline, 1,2,3,4-tetrahydro-2-methyl-7-(3,4,5-trimethoxybenzamido)-RefChem:322080DTXCID101134133,4,5-trimethoxy-n-(2-methyl-1,2,3,4-tetrahydroisoquinolin-7-yl)benzamideSCHEMBL6293964AHONRCXNXUBHGE-UHFFFAOYSA-N7-(3,4,5-Trimethoxybenzamido)-2-methyl-1,2,3,4-tetrahydroisoquinoline
Show more names
3,4,5-Trimethoxy-N-(1,2,3,4-tetrahydro-2-methylisoquinolin-7-yl)benzamideBenzamide, 3,4,5-trimethoxy-N-(1,2,3,4-tetrahydro-2-methyl-7-isoquinolinyl)-

Database identifiers

CAS
37481-34-8
PubChem CID
216591
DTXSID
DTXSID70190922
Nikkaji
J54.843J

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
60 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
26
Formal charge
0
Complexity
461

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Related reactions

2 records
New reaction record
HRID 2314818 reaction equation
HRID 2314818As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)
HRID 2397936 reaction equation
HRID 2397936As productuspto-grants-1977_05

Compound notes

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