2-[3-(3-bromophenyl)propanoylamino]benzoic acid

Systemtic Name: 2-[3-(3-bromophenyl)propanoylamino]benzoic acid Openeye Name: 2-[3-(3-bromophenyl)propanoylamino]benzoic acid CAS Name: 2-[[3-(3-bromophenyl)-1-oxopropyl]amino]benzoic acid IUPAC Name: 2-[3-(3-bromophenyl)propanoylamino]benzoic acid Traditional Name: 2-[3-(3-bromophenyl)propanoylamino]benzoic acid Formula: C16H14BrNO3 MolecularWeight: 348.19126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCC2=CC(=CC=C2)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCC2=CC(=CC=C2)Br

InChI

InChI=1S/C16H14BrNO3/c17-12-5-3-4-11(10-12)8-9-15(19)18-14-7-2-1-6-13(14)16(20)21/h1-7,10H,8-9H2,(H,18,19)(H,20,21)