3-[(3-bromanyl-4-fluoranyl-phenyl)methylamino]-4-fluoranyl-benzoic acid

Systemtic Name: 3-[(3-bromanyl-4-fluoranyl-phenyl)methylamino]-4-fluoranyl-benzoic acid Openeye Name: 3-[(3-bromo-4-fluoro-phenyl)methylamino]-4-fluoro-benzoic acid CAS Name: 3-[(3-bromo-4-fluorophenyl)methylamino]-4-fluorobenzoic acid IUPAC Name: 3-[(3-bromo-4-fluorophenyl)methylamino]-4-fluorobenzoic acid Traditional Name: 3-[(3-bromo-4-fluoro-benzyl)amino]-4-fluoro-benzoic acid Formula: C14H10BrF2NO2 MolecularWeight: 342.135506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNC2=C(C=CC(=C2)C(=O)O)F)Br)F

Isomeric SMILES

C1=CC(=C(C=C1CNC2=C(C=CC(=C2)C(=O)O)F)Br)F

InChI

InChI=1S/C14H10BrF2NO2/c15-10-5-8(1-3-11(10)16)7-18-13-6-9(14(19)20)2-4-12(13)17/h1-6,18H,7H2,(H,19,20)