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

Systemtic Name: 3-[(3-bromophenyl)methylamino]-4-fluoranyl-benzoic acid Openeye Name: 3-[(3-bromophenyl)methylamino]-4-fluoro-benzoic acid CAS Name: 3-[(3-bromophenyl)methylamino]-4-fluorobenzoic acid IUPAC Name: 3-[(3-bromophenyl)methylamino]-4-fluorobenzoic acid Traditional Name: 3-[(3-bromobenzyl)amino]-4-fluoro-benzoic acid Formula: C14H11BrFNO2 MolecularWeight: 324.145043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CNC2=C(C=CC(=C2)C(=O)O)F

Isomeric SMILES

C1=CC(=CC(=C1)Br)CNC2=C(C=CC(=C2)C(=O)O)F

InChI

InChI=1S/C14H11BrFNO2/c15-11-3-1-2-9(6-11)8-17-13-7-10(14(18)19)4-5-12(13)16/h1-7,17H,8H2,(H,18,19)