2-methyl-2-(4-nitropyrazol-1-yl)propanoate

Systemtic Name: 2-methyl-2-(4-nitropyrazol-1-yl)propanoate Openeye Name: 2-methyl-2-(4-nitropyrazol-1-yl)propanoate CAS Name: 2-methyl-2-(4-nitro-1-pyrazolyl)propanoate IUPAC Name: 2-methyl-2-(4-nitropyrazol-1-yl)propanoate Traditional Name: 2-methyl-2-(4-nitropyrazol-1-yl)propionate Formula: C7H8N3O4- MolecularWeight: 198.15612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H9N3O4/c1-7(2,6(11)12)9-4-5(3-8-9)10(13)14/h3-4H,1-2H3,(H,11,12)/p-1