4-(3-methyl-4-nitro-pyrazol-1-yl)butanoate

Systemtic Name: 4-(3-methyl-4-nitro-pyrazol-1-yl)butanoate Openeye Name: 4-(3-methyl-4-nitro-pyrazol-1-yl)butanoate CAS Name: 4-(3-methyl-4-nitro-1-pyrazolyl)butanoate IUPAC Name: 4-(3-methyl-4-nitropyrazol-1-yl)butanoate Traditional Name: 4-(3-methyl-4-nitro-pyrazol-1-yl)butyrate Formula: C8H10N3O4- MolecularWeight: 212.1827

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1[N+](=O)[O-])CCCC(=O)[O-]

Isomeric SMILES

CC1=NN(C=C1[N+](=O)[O-])CCCC(=O)[O-]

InChI

InChI=1S/C8H11N3O4/c1-6-7(11(14)15)5-10(9-6)4-2-3-8(12)13/h5H,2-4H2,1H3,(H,12,13)/p-1