ethyl 4-[[(E)-3-[(3-chlorophenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]amino]benzoate

Systemtic Name: ethyl 4-[[(E)-3-[(3-chlorophenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]amino]benzoate Openeye Name: ethyl 4-[[(E)-3-(3-chloroanilino)-2-cyano-3-oxo-prop-1-enyl]amino]benzoate CAS Name: 4-[[(E)-3-(3-chloroanilino)-2-cyano-3-oxoprop-1-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-3-(3-chloroanilino)-2-cyano-3-oxoprop-1-enyl]amino]benzoate Traditional Name: 4-[[(E)-3-(3-chloroanilino)-2-cyano-3-keto-prop-1-enyl]amino]benzoic acid ethyl ester Formula: C19H16ClN3O3 MolecularWeight: 369.80164

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC=C(C#N)C(=O)NC2=CC(=CC=C2)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N/C=C(\C#N)/C(=O)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C19H16ClN3O3/c1-2-26-19(25)13-6-8-16(9-7-13)22-12-14(11-21)18(24)23-17-5-3-4-15(20)10-17/h3-10,12,22H,2H2,1H3,(H,23,24)/b14-12+