2-[5-[4-(3,4-dimethylphenyl)phenyl]-2-methyl-pyrazol-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[5-[4-(3,4-dimethylphenyl)phenyl]-2-methyl-pyrazol-3-yl]isoindole-1,3-dione Openeye Name: 2-[5-[4-(3,4-dimethylphenyl)phenyl]-2-methyl-pyrazol-3-yl]isoindoline-1,3-dione CAS Name: 2-[5-[4-(3,4-dimethylphenyl)phenyl]-2-methyl-3-pyrazolyl]isoindole-1,3-dione IUPAC Name: 2-[5-[4-(3,4-dimethylphenyl)phenyl]-2-methylpyrazol-3-yl]isoindole-1,3-dione Traditional Name: 2-[5-[4-(3,4-dimethylphenyl)phenyl]-2-methyl-pyrazol-3-yl]isoindoline-1,3-quinone Formula: C26H21N3O2 MolecularWeight: 407.46384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(C=C2)C3=NN(C(=C3)N4C(=O)C5=CC=CC=C5C4=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(C=C2)C3=NN(C(=C3)N4C(=O)C5=CC=CC=C5C4=O)C)C

InChI

InChI=1S/C26H21N3O2/c1-16-8-9-20(14-17(16)2)18-10-12-19(13-11-18)23-15-24(28(3)27-23)29-25(30)21-6-4-5-7-22(21)26(29)31/h4-15H,1-3H3