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

Systemtic Name: 4-[[(3-bromophenyl)methylamino]methyl]benzoic acid Openeye Name: 4-[[(3-bromophenyl)methylamino]methyl]benzoic acid CAS Name: 4-[[(3-bromophenyl)methylamino]methyl]benzoic acid IUPAC Name: 4-[[(3-bromophenyl)methylamino]methyl]benzoic acid Traditional Name: 4-[[(3-bromobenzyl)amino]methyl]benzoic acid Formula: C15H14BrNO2 MolecularWeight: 320.18116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CNCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)CNCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C15H14BrNO2/c16-14-3-1-2-12(8-14)10-17-9-11-4-6-13(7-5-11)15(18)19/h1-8,17H,9-10H2,(H,18,19)