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

Systemtic Name: 4-[[2-(2-methylphenyl)ethanoylamino]methyl]benzoic acid Openeye Name: 4-[[[2-(o-tolyl)acetyl]amino]methyl]benzoic acid CAS Name: 4-[[[2-(2-methylphenyl)-1-oxoethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[2-(2-methylphenyl)acetyl]amino]methyl]benzoic acid Traditional Name: 4-[[[2-(o-tolyl)acetyl]amino]methyl]benzoic acid Formula: C17H17NO3 MolecularWeight: 283.32178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C17H17NO3/c1-12-4-2-3-5-15(12)10-16(19)18-11-13-6-8-14(9-7-13)17(20)21/h2-9H,10-11H2,1H3,(H,18,19)(H,20,21)