3-[(4-cyanophenyl)methylamino]-4-fluoranyl-benzoic acid

Systemtic Name: 3-[(4-cyanophenyl)methylamino]-4-fluoranyl-benzoic acid Openeye Name: 3-[(4-cyanophenyl)methylamino]-4-fluoro-benzoic acid CAS Name: 3-[(4-cyanophenyl)methylamino]-4-fluorobenzoic acid IUPAC Name: 3-[(4-cyanophenyl)methylamino]-4-fluorobenzoic acid Traditional Name: 3-[(4-cyanobenzyl)amino]-4-fluoro-benzoic acid Formula: C15H11FN2O2 MolecularWeight: 270.258443

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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