4-[3-(4-methylphenyl)propanoylamino]benzoic acid

Systemtic Name: 4-[3-(4-methylphenyl)propanoylamino]benzoic acid Openeye Name: 4-[3-(p-tolyl)propanoylamino]benzoic acid CAS Name: 4-[[3-(4-methylphenyl)-1-oxopropyl]amino]benzoic acid IUPAC Name: 4-[3-(4-methylphenyl)propanoylamino]benzoic acid Traditional Name: 4-[3-(p-tolyl)propanoylamino]benzoic acid Formula: C17H17NO3 MolecularWeight: 283.32178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CCC(=O)NC2=CC=C(C=C2)C(=O)O

InChI

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