4-[3-(4-ethylphenyl)propanoylamino]-3-methyl-benzoic acid

Systemtic Name: 4-[3-(4-ethylphenyl)propanoylamino]-3-methyl-benzoic acid Openeye Name: 4-[3-(4-ethylphenyl)propanoylamino]-3-methyl-benzoic acid CAS Name: 4-[[3-(4-ethylphenyl)-1-oxopropyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[3-(4-ethylphenyl)propanoylamino]-3-methylbenzoic acid Traditional Name: 4-[3-(4-ethylphenyl)propanoylamino]-3-methyl-benzoic acid Formula: C19H21NO3 MolecularWeight: 311.37494

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CCC(=O)NC2=C(C=C(C=C2)C(=O)O)C

Isomeric SMILES

CCC1=CC=C(C=C1)CCC(=O)NC2=C(C=C(C=C2)C(=O)O)C

InChI

InChI=1S/C19H21NO3/c1-3-14-4-6-15(7-5-14)8-11-18(21)20-17-10-9-16(19(22)23)12-13(17)2/h4-7,9-10,12H,3,8,11H2,1-2H3,(H,20,21)(H,22,23)