methyl 3-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]-1H-indole-2-carboxylate

Systemtic Name: methyl 3-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]-1H-indole-2-carboxylate Openeye Name: methyl 3-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]-1H-indole-2-carboxylate CAS Name: 3-[[(E)-3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]-1H-indole-2-carboxylate Traditional Name: 3-[[(E)-3-(3,4-dimethoxyphenyl)acryloyl]amino]-1H-indole-2-carboxylic acid methyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC2=C(NC3=CC=CC=C32)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NC2=C(NC3=CC=CC=C32)C(=O)OC)OC

InChI

InChI=1S/C21H20N2O5/c1-26-16-10-8-13(12-17(16)27-2)9-11-18(24)23-19-14-6-4-5-7-15(14)22-20(19)21(25)28-3/h4-12,22H,1-3H3,(H,23,24)/b11-9+