methyl (2S)-2-(4-oxidanylidenepentanoylamino)-2-phenyl-ethanoate

Systemtic Name: methyl (2S)-2-(4-oxidanylidenepentanoylamino)-2-phenyl-ethanoate Openeye Name: methyl (2S)-2-(4-oxopentanoylamino)-2-phenyl-acetate CAS Name: (2S)-2-(1,4-dioxopentylamino)-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-(4-oxopentanoylamino)-2-phenylacetate Traditional Name: (2S)-2-(4-ketopentanoylamino)-2-phenyl-acetic acid methyl ester Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)CCC(=O)N[C@@H](C1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C14H17NO4/c1-10(16)8-9-12(17)15-13(14(18)19-2)11-6-4-3-5-7-11/h3-7,13H,8-9H2,1-2H3,(H,15,17)/t13-/m0/s1