2-methyl-3-(4-nitropyrazol-1-yl)propanoate

Systemtic Name: 2-methyl-3-(4-nitropyrazol-1-yl)propanoate Openeye Name: 2-methyl-3-(4-nitropyrazol-1-yl)propanoate CAS Name: 2-methyl-3-(4-nitro-1-pyrazolyl)propanoate IUPAC Name: 2-methyl-3-(4-nitropyrazol-1-yl)propanoate Traditional Name: 2-methyl-3-(4-nitropyrazol-1-yl)propionate Formula: C7H8N3O4- MolecularWeight: 198.15612

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C7H9N3O4/c1-5(7(11)12)3-9-4-6(2-8-9)10(13)14/h2,4-5H,3H2,1H3,(H,11,12)/p-1