methyl 4-[(E)-3-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-(3-chloro-4-fluoro-anilino)-2-cyano-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-(3-chloro-4-fluoroanilino)-2-cyano-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-(3-chloro-4-fluoroanilino)-2-cyano-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-(3-chloro-4-fluoro-anilino)-2-cyano-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C18H12ClFN2O3 MolecularWeight: 358.750883

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12ClFN2O3/c1-25-18(24)12-4-2-11(3-5-12)8-13(10-21)17(23)22-14-6-7-16(20)15(19)9-14/h2-9H,1H3,(H,22,23)/b13-8+