2-[(1,3-diphenylpyrazol-4-yl)methyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[(1,3-diphenylpyrazol-4-yl)methyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[(1,3-diphenylpyrazol-4-yl)methyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[(1,3-diphenyl-4-pyrazolyl)methyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[(1,3-diphenylpyrazol-4-yl)methyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[(1,3-diphenylpyrazol-4-yl)methyl]-4-nitro-isoindoline-1,3-quinone Formula: C24H16N4O4 MolecularWeight: 424.40824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C24H16N4O4/c29-23-19-12-7-13-20(28(31)32)21(19)24(30)26(23)14-17-15-27(18-10-5-2-6-11-18)25-22(17)16-8-3-1-4-9-16/h1-13,15H,14H2