methyl 4-methyl-3-(2-phenylbutanoylamino)benzoate

Systemtic Name: methyl 4-methyl-3-(2-phenylbutanoylamino)benzoate Openeye Name: methyl 4-methyl-3-(2-phenylbutanoylamino)benzoate CAS Name: 4-methyl-3-[(1-oxo-2-phenylbutyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-(2-phenylbutanoylamino)benzoate Traditional Name: 4-methyl-3-(2-phenylbutanoylamino)benzoic acid methyl ester Formula: C19H21NO3 MolecularWeight: 311.37494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO3/c1-4-16(14-8-6-5-7-9-14)18(21)20-17-12-15(19(22)23-3)11-10-13(17)2/h5-12,16H,4H2,1-3H3,(H,20,21)