[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] (2S)-3-methyl-2-[(2-methylphenyl)carbonylamino]butanoate

Systemtic Name: [4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] (2S)-3-methyl-2-[(2-methylphenyl)carbonylamino]butanoate Openeye Name: [4-(2-oxopyrrolidin-1-yl)phenyl] (2S)-3-methyl-2-[(2-methylbenzoyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[[(2-methylphenyl)-oxomethyl]amino]butanoic acid [4-(2-oxo-1-pyrrolidinyl)phenyl] ester IUPAC Name: [4-(2-oxopyrrolidin-1-yl)phenyl] (2S)-3-methyl-2-[(2-methylbenzoyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-(o-toluoylamino)butyric acid [4-(2-ketopyrrolidino)phenyl] ester Formula: C23H26N2O4 MolecularWeight: 394.46354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)OC2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)OC2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C23H26N2O4/c1-15(2)21(24-22(27)19-8-5-4-7-16(19)3)23(28)29-18-12-10-17(11-13-18)25-14-6-9-20(25)26/h4-5,7-8,10-13,15,21H,6,9,14H2,1-3H3,(H,24,27)/t21-/m0/s1