ethyl 3-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 3-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]-1H-indole-2-carboxylate CAS Name: 3-[[3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]-1H-indole-2-carboxylate Traditional Name: 3-[[3-(3,4-dimethoxyphenyl)acryloyl]amino]-1H-indole-2-carboxylic acid ethyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)C=CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)C=CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H22N2O5/c1-4-29-22(26)21-20(15-7-5-6-8-16(15)23-21)24-19(25)12-10-14-9-11-17(27-2)18(13-14)28-3/h5-13,23H,4H2,1-3H3,(H,24,25)