[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 3-fluoranyl-4-methoxy-benzoate

Systemtic Name: [2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 3-fluoranyl-4-methoxy-benzoate Openeye Name: [2-(3-cyanoanilino)-2-oxo-ethyl] 3-fluoro-4-methoxy-benzoate CAS Name: 3-fluoro-4-methoxybenzoic acid [2-(3-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-cyanoanilino)-2-oxoethyl] 3-fluoro-4-methoxybenzoate Traditional Name: 3-fluoro-4-methoxy-benzoic acid [2-(3-cyanoanilino)-2-keto-ethyl] ester Formula: C17H13FN2O4 MolecularWeight: 328.294523

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC=CC(=C2)C#N)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC=CC(=C2)C#N)F

InChI

InChI=1S/C17H13FN2O4/c1-23-15-6-5-12(8-14(15)18)17(22)24-10-16(21)20-13-4-2-3-11(7-13)9-19/h2-8H,10H2,1H3,(H,20,21)