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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CCCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CCCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C19H21NO3/c1-14-16(19(22)23-2)11-7-12-17(14)20-18(21)13-6-10-15-8-4-3-5-9-15/h3-5,7-9,11-12H,6,10,13H2,1-2H3,(H,20,21)