[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] (2S)-3-methyl-2-(2-phenoxyethanoylamino)butanoate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] (2S)-3-methyl-2-(2-phenoxyethanoylamino)butanoate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] (2S)-3-methyl-2-[(2-phenoxyacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenoxyethyl)amino]butanoic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] (2S)-3-methyl-2-[(2-phenoxyacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenoxyacetyl)amino]butyric acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H26N2O5 MolecularWeight: 350.40944

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)C(C(C)C)NC(=O)COC1=CC=CC=C1

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)[C@H](C(C)C)NC(=O)COC1=CC=CC=C1

InChI

InChI=1S/C18H26N2O5/c1-5-19-17(22)13(4)25-18(23)16(12(2)3)20-15(21)11-24-14-9-7-6-8-10-14/h6-10,12-13,16H,5,11H2,1-4H3,(H,19,22)(H,20,21)/t13-,16-/m0/s1