methyl 2-[[(Z)-2-cyano-3-oxidanylidene-3-(phenethylamino)prop-1-enyl]amino]benzoate

Systemtic Name: methyl 2-[[(Z)-2-cyano-3-oxidanylidene-3-(phenethylamino)prop-1-enyl]amino]benzoate Openeye Name: methyl 2-[[(Z)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]amino]benzoate CAS Name: 2-[[(Z)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(Z)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]amino]benzoate Traditional Name: 2-[[(Z)-2-cyano-3-keto-3-(phenethylamino)prop-1-enyl]amino]benzoic acid methyl ester Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC=C(C#N)C(=O)NCCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=CC=C1N/C=C(/C#N)\C(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C20H19N3O3/c1-26-20(25)17-9-5-6-10-18(17)23-14-16(13-21)19(24)22-12-11-15-7-3-2-4-8-15/h2-10,14,23H,11-12H2,1H3,(H,22,24)/b16-14-