phenacyl (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate

Systemtic Name: phenacyl (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: phenacyl (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoic acid phenacyl ester IUPAC Name: phenacyl (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]butyric acid phenacyl ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO4/c1-15(2)20(22-19(24)13-16-9-5-3-6-10-16)21(25)26-14-18(23)17-11-7-4-8-12-17/h3-12,15,20H,13-14H2,1-2H3,(H,22,24)/t20-/m0/s1