3,5-dimethyl-1-(4-nitrophenyl)pyrazole-4-carboxylic acid

Systemtic Name: 3,5-dimethyl-1-(4-nitrophenyl)pyrazole-4-carboxylic acid Openeye Name: 3,5-dimethyl-1-(4-nitrophenyl)pyrazole-4-carboxylic acid CAS Name: 3,5-dimethyl-1-(4-nitrophenyl)-4-pyrazolecarboxylic acid IUPAC Name: 3,5-dimethyl-1-(4-nitrophenyl)pyrazole-4-carboxylic acid Traditional Name: 3,5-dimethyl-1-(4-nitrophenyl)pyrazole-4-carboxylic acid Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C)C(=O)O

InChI

InChI=1S/C12H11N3O4/c1-7-11(12(16)17)8(2)14(13-7)9-3-5-10(6-4-9)15(18)19/h3-6H,1-2H3,(H,16,17)