[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]butyric acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C19H22N2O4 MolecularWeight: 342.38898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)C1=CC=CN1)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)C1=CC=CN1)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C19H22N2O4/c1-13(2)18(21-17(23)11-14-7-4-3-5-8-14)19(24)25-12-16(22)15-9-6-10-20-15/h3-10,13,18,20H,11-12H2,1-2H3,(H,21,23)/t18-/m0/s1