[3-[(E)-2-cyano-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]phenyl] 3-fluoranylbenzoate

Systemtic Name: [3-[(E)-2-cyano-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]phenyl] 3-fluoranylbenzoate Openeye Name: [3-[(E)-3-anilino-2-cyano-3-oxo-prop-1-enyl]phenyl] 3-fluorobenzoate CAS Name: 3-fluorobenzoic acid [3-[(E)-3-anilino-2-cyano-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [3-[(E)-3-anilino-2-cyano-3-oxoprop-1-enyl]phenyl] 3-fluorobenzoate Traditional Name: 3-fluorobenzoic acid [3-[(E)-3-anilino-2-cyano-3-keto-prop-1-enyl]phenyl] ester Formula: C23H15FN2O3 MolecularWeight: 386.375203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C(=CC2=CC(=CC=C2)OC(=O)C3=CC(=CC=C3)F)C#N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)/C(=C/C2=CC(=CC=C2)OC(=O)C3=CC(=CC=C3)F)/C#N

InChI

InChI=1S/C23H15FN2O3/c24-19-8-5-7-17(14-19)23(28)29-21-11-4-6-16(13-21)12-18(15-25)22(27)26-20-9-2-1-3-10-20/h1-14H,(H,26,27)/b18-12+