[(2S)-4-(2-methyl-3-oxidanylidene-1H-pyrazol-4-yl)-1-oxidanyl-1-oxidanylidene-butan-2-yl]azanium chloride

Systemtic Name: [(2S)-4-(2-methyl-3-oxidanylidene-1H-pyrazol-4-yl)-1-oxidanyl-1-oxidanylidene-butan-2-yl]azanium chloride Openeye Name: [(1S)-1-carboxy-3-(2-methyl-3-oxo-1H-pyrazol-4-yl)propyl]ammonium chloride CAS Name: [(2S)-1-hydroxy-4-(2-methyl-3-oxo-1H-pyrazol-4-yl)-1-oxobutan-2-yl]ammonium chloride IUPAC Name: [(2S)-1-hydroxy-4-(2-methyl-3-oxo-1H-pyrazol-4-yl)-1-oxobutan-2-yl]azanium chloride Traditional Name: [(1S)-1-carboxy-3-(5-keto-1-methyl-3-pyrazolin-4-yl)propyl]ammonium chloride Formula: C8H14ClN3O3 MolecularWeight: 235.66806

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CN1)CCC(C(=O)O)[NH3+].[Cl-]

Isomeric SMILES

CN1C(=O)C(=CN1)CC[C@@H](C(=O)O)[NH3+].[Cl-]

InChI

InChI=1S/C8H13N3O3.ClH/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);1H/t6-;/m0./s1