4-ethenyl-3-nitro-pyrazole-1-carboxylic acid

Systemtic Name: 4-ethenyl-3-nitro-pyrazole-1-carboxylic acid Openeye Name: 3-nitro-4-vinyl-pyrazole-1-carboxylic acid CAS Name: 4-ethenyl-3-nitro-1-pyrazolecarboxylic acid IUPAC Name: 4-ethenyl-3-nitropyrazole-1-carboxylic acid Traditional Name: 3-nitro-4-vinyl-pyrazole-1-carboxylic acid Formula: C6H5N3O4 MolecularWeight: 183.1216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H5N3O4/c1-2-4-3-8(6(10)11)7-5(4)9(12)13/h2-3H,1H2,(H,10,11)