4-[(2-cyano-3-fluoranyl-phenyl)carbamoyl]benzoic acid

Systemtic Name: 4-[(2-cyano-3-fluoranyl-phenyl)carbamoyl]benzoic acid Openeye Name: 4-[(2-cyano-3-fluoro-phenyl)carbamoyl]benzoic acid CAS Name: 4-[(2-cyano-3-fluoroanilino)-oxomethyl]benzoic acid IUPAC Name: 4-[(2-cyano-3-fluorophenyl)carbamoyl]benzoic acid Traditional Name: 4-[(2-cyano-3-fluoro-phenyl)carbamoyl]benzoic acid Formula: C15H9FN2O3 MolecularWeight: 284.241963

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H9FN2O3/c16-12-2-1-3-13(11(12)8-17)18-14(19)9-4-6-10(7-5-9)15(20)21/h1-7H,(H,18,19)(H,20,21)