4-bromanyl-2-[(3-fluorophenyl)methyl-methyl-amino]benzoic acid

Systemtic Name: 4-bromanyl-2-[(3-fluorophenyl)methyl-methyl-amino]benzoic acid Openeye Name: 4-bromo-2-[(3-fluorophenyl)methyl-methyl-amino]benzoic acid CAS Name: 4-bromo-2-[(3-fluorophenyl)methyl-methylamino]benzoic acid IUPAC Name: 4-bromo-2-[(3-fluorophenyl)methyl-methylamino]benzoic acid Traditional Name: 4-bromo-2-[(3-fluorobenzyl)-methyl-amino]benzoic acid Formula: C15H13BrFNO2 MolecularWeight: 338.171623

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)F)C2=C(C=CC(=C2)Br)C(=O)O

Isomeric SMILES

CN(CC1=CC(=CC=C1)F)C2=C(C=CC(=C2)Br)C(=O)O

InChI

InChI=1S/C15H13BrFNO2/c1-18(9-10-3-2-4-12(17)7-10)14-8-11(16)5-6-13(14)15(19)20/h2-8H,9H2,1H3,(H,19,20)