(2S)-2-azanyl-4-(2-methyl-3-oxidanylidene-1H-pyrazol-4-yl)butanoic acid

Systemtic Name: (2S)-2-azanyl-4-(2-methyl-3-oxidanylidene-1H-pyrazol-4-yl)butanoic acid Openeye Name: (2S)-2-amino-4-(2-methyl-3-oxo-1H-pyrazol-4-yl)butanoic acid CAS Name: (2S)-2-amino-4-(2-methyl-3-oxo-1H-pyrazol-4-yl)butanoic acid IUPAC Name: (2S)-2-amino-4-(2-methyl-3-oxo-1H-pyrazol-4-yl)butanoic acid Traditional Name: (2S)-2-amino-4-(5-keto-1-methyl-3-pyrazolin-4-yl)butyric acid Formula: C8H13N3O3 MolecularWeight: 199.20712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CN1)CCC(C(=O)O)N

Isomeric SMILES

CN1C(=O)C(=CN1)CC[C@@H](C(=O)O)N

InChI

InChI=1S/C8H13N3O3/c1-11-7(12)5(4-10-11)2-3-6(9)8(13)14/h4,6,10H,2-3,9H2,1H3,(H,13,14)/t6-/m0/s1