[(2R)-1-oxidanylidene-1-(propylamino)propan-2-yl] (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-(propylamino)propan-2-yl] (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: [(1R)-1-methyl-2-oxo-2-(propylamino)ethyl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoic acid [(2R)-1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(propylamino)propan-2-yl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]butyric acid [(1R)-2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C19H28N2O4 MolecularWeight: 348.43662

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C(C(C)C)NC(=O)CC1=CC=CC=C1

Isomeric SMILES

CCCNC(=O)[C@@H](C)OC(=O)[C@H](C(C)C)NC(=O)CC1=CC=CC=C1

InChI

InChI=1S/C19H28N2O4/c1-5-11-20-18(23)14(4)25-19(24)17(13(2)3)21-16(22)12-15-9-7-6-8-10-15/h6-10,13-14,17H,5,11-12H2,1-4H3,(H,20,23)(H,21,22)/t14-,17+/m1/s1