3-[(4-bromanyl-2-fluoranyl-phenyl)methylamino]-4-fluoranyl-benzoic acid

Systemtic Name: 3-[(4-bromanyl-2-fluoranyl-phenyl)methylamino]-4-fluoranyl-benzoic acid Openeye Name: 3-[(4-bromo-2-fluoro-phenyl)methylamino]-4-fluoro-benzoic acid CAS Name: 3-[(4-bromo-2-fluorophenyl)methylamino]-4-fluorobenzoic acid IUPAC Name: 3-[(4-bromo-2-fluorophenyl)methylamino]-4-fluorobenzoic acid Traditional Name: 3-[(4-bromo-2-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=C1C(=O)O)NCC2=C(C=C(C=C2)Br)F)F

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)NCC2=C(C=C(C=C2)Br)F)F

InChI

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