(2S)-2-(5-methyl-3-nitro-pyrazol-1-yl)butanoate

Systemtic Name: (2S)-2-(5-methyl-3-nitro-pyrazol-1-yl)butanoate Openeye Name: (2S)-2-(5-methyl-3-nitro-pyrazol-1-yl)butanoate CAS Name: (2S)-2-(5-methyl-3-nitro-1-pyrazolyl)butanoate IUPAC Name: (2S)-2-(5-methyl-3-nitropyrazol-1-yl)butanoate Traditional Name: (2S)-2-(5-methyl-3-nitro-pyrazol-1-yl)butyrate Formula: C8H10N3O4- MolecularWeight: 212.1827

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])N1C(=CC(=N1)[N+](=O)[O-])C

Isomeric SMILES

CC[C@@H](C(=O)[O-])N1C(=CC(=N1)[N+](=O)[O-])C

InChI

InChI=1S/C8H11N3O4/c1-3-6(8(12)13)10-5(2)4-7(9-10)11(14)15/h4,6H,3H2,1-2H3,(H,12,13)/p-1/t6-/m0/s1