1-(4-methylphenyl)-3-(2-nitrophenyl)pyrazole-4-carboxylic acid

Systemtic Name: 1-(4-methylphenyl)-3-(2-nitrophenyl)pyrazole-4-carboxylic acid Openeye Name: 3-(2-nitrophenyl)-1-(p-tolyl)pyrazole-4-carboxylic acid CAS Name: 1-(4-methylphenyl)-3-(2-nitrophenyl)-4-pyrazolecarboxylic acid IUPAC Name: 1-(4-methylphenyl)-3-(2-nitrophenyl)pyrazole-4-carboxylic acid Traditional Name: 3-(2-nitrophenyl)-1-(p-tolyl)pyrazole-4-carboxylic acid Formula: C17H13N3O4 MolecularWeight: 323.30282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CC=C3[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CC=C3[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H13N3O4/c1-11-6-8-12(9-7-11)19-10-14(17(21)22)16(18-19)13-4-2-3-5-15(13)20(23)24/h2-10H,1H3,(H,21,22)