(2R)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoate

Systemtic Name: (2R)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoate Openeye Name: (2R)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoate CAS Name: (2R)-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)propanoate IUPAC Name: (2R)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoate Traditional Name: (2R)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propionate Formula: C8H10N3O4- MolecularWeight: 212.1827

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1[C@H](C)C(=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C8H11N3O4/c1-4-7(11(14)15)5(2)10(9-4)6(3)8(12)13/h6H,1-3H3,(H,12,13)/p-1/t6-/m1/s1