ethyl 2-[3-[(Z)-2-cyano-3-[(3-ethoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]indol-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-[(Z)-2-cyano-3-[(3-ethoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]indol-1-yl]ethanoate Openeye Name: ethyl 2-[3-[(Z)-2-cyano-3-(3-ethoxyanilino)-3-oxo-prop-1-enyl]indol-1-yl]acetate CAS Name: 2-[3-[(Z)-2-cyano-3-(3-ethoxyanilino)-3-oxoprop-1-enyl]-1-indolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[(Z)-2-cyano-3-(3-ethoxyanilino)-3-oxoprop-1-enyl]indol-1-yl]acetate Traditional Name: 2-[3-[(Z)-2-cyano-3-keto-3-(m-phenetidino)prop-1-enyl]indol-1-yl]acetic acid ethyl ester Formula: C24H23N3O4 MolecularWeight: 417.45712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)OCC)C#N

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=O)/C(=C\C2=CN(C3=CC=CC=C32)CC(=O)OCC)/C#N

InChI

InChI=1S/C24H23N3O4/c1-3-30-20-9-7-8-19(13-20)26-24(29)17(14-25)12-18-15-27(16-23(28)31-4-2)22-11-6-5-10-21(18)22/h5-13,15H,3-4,16H2,1-2H3,(H,26,29)/b17-12-