(S)-2-{2[2-(1-methoxycarbonylethoxy)phenyl]vinyl}-1-methylindole

HCID 69953350
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Basic information

Standard SMILES
COC(=O)[C@H](C)Oc1ccccc1C=Cc1cc2ccccc2n1C
InChIKey
QBNVREVOUVUDOG-HNNXBMFYSA-N
Molecular formula
C21H21NO3
Average molar mass
335.4 g/mol
Monoisotopic mass
335.15214353

Names & identifiers

Preferred name
(S)-2-{2[2-(1-methoxycarbonylethoxy)phenyl]vinyl}-1-methylindole
IUPAC
methyl (2S)-2-[2-[2-(1-methylindol-2-yl)ethenyl]phenoxy]propanoate

Names & synonyms

SCHEMBL6987722QBNVREVOUVUDOG-HNNXBMFYSA-N(S)-2-{2[2-(1-methoxycarbonylethoxy)phenyl]vinyl}-1-methylindole

Database identifiers

PubChem CID
69953350

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
40.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
25

Related reactions

1 records
New reaction record

Linked notes

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(S)-2-{2[2-(1-methoxycarbonylethoxy)phenyl]vinyl}-1-methylindole (HCID 69953350)｜Huagongshe