(2S)-2-azanyl-5-(1-cyanoethylamino)-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-(1-cyanoethylamino)-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-(1-cyanoethylamino)-5-oxo-pentanoic acid CAS Name: (2S)-2-amino-5-(1-cyanoethylamino)-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-(1-cyanoethylamino)-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-(1-cyanoethylamino)-5-keto-valeric acid Formula: C8H13N3O3 MolecularWeight: 199.20712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)NC(=O)CCC(C(=O)O)N

Isomeric SMILES

CC(C#N)NC(=O)CC[C@@H](C(=O)O)N

InChI

InChI=1S/C8H13N3O3/c1-5(4-9)11-7(12)3-2-6(10)8(13)14/h5-6H,2-3,10H2,1H3,(H,11,12)(H,13,14)/t5?,6-/m0/s1