(4-methylphenyl) 4-nitropyrazole-1-carboxylate

Systemtic Name: (4-methylphenyl) 4-nitropyrazole-1-carboxylate Openeye Name: p-tolyl 4-nitropyrazole-1-carboxylate CAS Name: 4-nitro-1-pyrazolecarboxylic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 4-nitropyrazole-1-carboxylate Traditional Name: 4-nitropyrazole-1-carboxylic acid p-tolyl ester Formula: C11H9N3O4 MolecularWeight: 247.20686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(=O)N2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OC(=O)N2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C11H9N3O4/c1-8-2-4-10(5-3-8)18-11(15)13-7-9(6-12-13)14(16)17/h2-7H,1H3