3-(5-methyl-3-nitro-pyrazol-1-yl)propanoic acid

Systemtic Name: 3-(5-methyl-3-nitro-pyrazol-1-yl)propanoic acid Openeye Name: 3-(5-methyl-3-nitro-pyrazol-1-yl)propanoic acid CAS Name: 3-(5-methyl-3-nitro-1-pyrazolyl)propanoic acid IUPAC Name: 3-(5-methyl-3-nitropyrazol-1-yl)propanoic acid Traditional Name: 3-(5-methyl-3-nitro-pyrazol-1-yl)propionic acid Formula: C7H9N3O4 MolecularWeight: 199.16406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C7H9N3O4/c1-5-4-6(10(13)14)8-9(5)3-2-7(11)12/h4H,2-3H2,1H3,(H,11,12)