2-bromanyl-4-[2-(2-methylphenyl)ethanoylamino]benzoic acid

Systemtic Name: 2-bromanyl-4-[2-(2-methylphenyl)ethanoylamino]benzoic acid Openeye Name: 2-bromo-4-[[2-(o-tolyl)acetyl]amino]benzoic acid CAS Name: 2-bromo-4-[[2-(2-methylphenyl)-1-oxoethyl]amino]benzoic acid IUPAC Name: 2-bromo-4-[[2-(2-methylphenyl)acetyl]amino]benzoic acid Traditional Name: 2-bromo-4-[[2-(o-tolyl)acetyl]amino]benzoic acid Formula: C16H14BrNO3 MolecularWeight: 348.19126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC2=CC(=C(C=C2)C(=O)O)Br

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC2=CC(=C(C=C2)C(=O)O)Br

InChI

InChI=1S/C16H14BrNO3/c1-10-4-2-3-5-11(10)8-15(19)18-12-6-7-13(16(20)21)14(17)9-12/h2-7,9H,8H2,1H3,(H,18,19)(H,20,21)