methyl (2S)-2-acetamido-3-oxidanylidene-pentanoate

Systemtic Name: methyl (2S)-2-acetamido-3-oxidanylidene-pentanoate Openeye Name: methyl (2S)-2-acetamido-3-oxo-pentanoate CAS Name: (2S)-2-acetamido-3-oxopentanoic acid methyl ester IUPAC Name: methyl (2S)-2-acetamido-3-oxopentanoate Traditional Name: (2S)-2-acetamido-3-keto-valeric acid methyl ester Formula: C8H13NO4 MolecularWeight: 187.19312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(=O)[C@@H](C(=O)OC)NC(=O)C

InChI

InChI=1S/C8H13NO4/c1-4-6(11)7(8(12)13-3)9-5(2)10/h7H,4H2,1-3H3,(H,9,10)/t7-/m0/s1