5-(4-methylphenyl)-2-(4-nitrophenyl)pyrazole-3,4-dione

Systemtic Name: 5-(4-methylphenyl)-2-(4-nitrophenyl)pyrazole-3,4-dione Openeye Name: 2-(4-nitrophenyl)-5-(p-tolyl)pyrazole-3,4-dione CAS Name: 5-(4-methylphenyl)-2-(4-nitrophenyl)pyrazole-3,4-dione IUPAC Name: 5-(4-methylphenyl)-2-(4-nitrophenyl)pyrazole-3,4-dione Traditional Name: 2-(4-nitrophenyl)-5-(p-tolyl)-2-pyrazoline-3,4-quinone Formula: C16H11N3O4 MolecularWeight: 309.27624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C2=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C2=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O4/c1-10-2-4-11(5-3-10)14-15(20)16(21)18(17-14)12-6-8-13(9-7-12)19(22)23/h2-9H,1H3