3-[2-(4-bromophenyl)ethanoylamino]-4-methyl-benzoic acid

Systemtic Name: 3-[2-(4-bromophenyl)ethanoylamino]-4-methyl-benzoic acid Openeye Name: 3-[[2-(4-bromophenyl)acetyl]amino]-4-methyl-benzoic acid CAS Name: 3-[[2-(4-bromophenyl)-1-oxoethyl]amino]-4-methylbenzoic acid IUPAC Name: 3-[[2-(4-bromophenyl)acetyl]amino]-4-methylbenzoic acid Traditional Name: 3-[[2-(4-bromophenyl)acetyl]amino]-4-methyl-benzoic acid Formula: C16H14BrNO3 MolecularWeight: 348.19126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC(=O)CC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC(=O)CC2=CC=C(C=C2)Br

InChI

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