methyl 4-[[(Z)-2-cyano-3-[(4-fluorophenyl)amino]-3-oxidanylidene-prop-1-enyl]amino]benzoate

Systemtic Name: methyl 4-[[(Z)-2-cyano-3-[(4-fluorophenyl)amino]-3-oxidanylidene-prop-1-enyl]amino]benzoate Openeye Name: methyl 4-[[(Z)-2-cyano-3-(4-fluoroanilino)-3-oxo-prop-1-enyl]amino]benzoate CAS Name: 4-[[(Z)-2-cyano-3-(4-fluoroanilino)-3-oxoprop-1-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(Z)-2-cyano-3-(4-fluoroanilino)-3-oxoprop-1-enyl]amino]benzoate Traditional Name: 4-[[(Z)-2-cyano-3-(4-fluoroanilino)-3-keto-prop-1-enyl]amino]benzoic acid methyl ester Formula: C18H14FN3O3 MolecularWeight: 339.320463

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC=C(C#N)C(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N/C=C(/C#N)\C(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C18H14FN3O3/c1-25-18(24)12-2-6-15(7-3-12)21-11-13(10-20)17(23)22-16-8-4-14(19)5-9-16/h2-9,11,21H,1H3,(H,22,23)/b13-11-