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

Systemtic Name: [(2S)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: [(1S)-1-methyl-2-(methylcarbamoylamino)-2-oxo-ethyl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoic acid [(2S)-1-(methylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(methylcarbamoylamino)-1-oxopropan-2-yl] (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]butyric acid [(1S)-2-keto-1-methyl-2-(methylcarbamoylamino)ethyl] ester Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O5/c1-11(2)15(20-14(22)10-13-8-6-5-7-9-13)17(24)26-12(3)16(23)21-18(25)19-4/h5-9,11-12,15H,10H2,1-4H3,(H,20,22)(H2,19,21,23,25)/t12-,15-/m0/s1