ethyl 2-[[(E)-2-cyano-3-(1H-indol-3-yl)prop-2-enoyl]amino]benzoate

Systemtic Name: ethyl 2-[[(E)-2-cyano-3-(1H-indol-3-yl)prop-2-enoyl]amino]benzoate Openeye Name: ethyl 2-[[(E)-2-cyano-3-(1H-indol-3-yl)prop-2-enoyl]amino]benzoate CAS Name: 2-[[(E)-2-cyano-3-(1H-indol-3-yl)-1-oxoprop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-2-cyano-3-(1H-indol-3-yl)prop-2-enoyl]amino]benzoate Traditional Name: 2-[[(E)-2-cyano-3-(1H-indol-3-yl)acryloyl]amino]benzoic acid ethyl ester Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)C(=CC2=CNC3=CC=CC=C32)C#N

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)/C(=C/C2=CNC3=CC=CC=C32)/C#N

InChI

InChI=1S/C21H17N3O3/c1-2-27-21(26)17-8-4-6-10-19(17)24-20(25)14(12-22)11-15-13-23-18-9-5-3-7-16(15)18/h3-11,13,23H,2H2,1H3,(H,24,25)/b14-11+