4-[[(4-cyano-2-fluoranyl-phenyl)amino]methyl]benzoic acid

Systemtic Name: 4-[[(4-cyano-2-fluoranyl-phenyl)amino]methyl]benzoic acid Openeye Name: 4-[(4-cyano-2-fluoro-anilino)methyl]benzoic acid CAS Name: 4-[(4-cyano-2-fluoroanilino)methyl]benzoic acid IUPAC Name: 4-[(4-cyano-2-fluoroanilino)methyl]benzoic acid Traditional Name: 4-[(4-cyano-2-fluoro-anilino)methyl]benzoic acid Formula: C15H11FN2O2 MolecularWeight: 270.258443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=C(C=C(C=C2)C#N)F)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNC2=C(C=C(C=C2)C#N)F)C(=O)O

InChI

InChI=1S/C15H11FN2O2/c16-13-7-11(8-17)3-6-14(13)18-9-10-1-4-12(5-2-10)15(19)20/h1-7,18H,9H2,(H,19,20)