2-(4-bromophenyl)-7a-methyl-4,7-diphenyl-4,7-dihydro-3aH-isoindole-1,3-dione

Systemtic Name: 2-(4-bromophenyl)-7a-methyl-4,7-diphenyl-4,7-dihydro-3aH-isoindole-1,3-dione Openeye Name: 2-(4-bromophenyl)-7a-methyl-4,7-diphenyl-4,7-dihydro-3aH-isoindole-1,3-dione CAS Name: 2-(4-bromophenyl)-7a-methyl-4,7-diphenyl-4,7-dihydro-3aH-isoindole-1,3-dione IUPAC Name: 2-(4-bromophenyl)-7a-methyl-4,7-diphenyl-4,7-dihydro-3aH-isoindole-1,3-dione Traditional Name: 2-(4-bromophenyl)-7a-methyl-4,7-diphenyl-4,7-dihydro-3aH-isoindole-1,3-quinone Formula: C27H22BrNO2 MolecularWeight: 472.37308

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Descriptors Computed from Structure

Canonical SMILES:

CC12C(C=CC(C1C(=O)N(C2=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC12C(C=CC(C1C(=O)N(C2=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H22BrNO2/c1-27-23(19-10-6-3-7-11-19)17-16-22(18-8-4-2-5-9-18)24(27)25(30)29(26(27)31)21-14-12-20(28)13-15-21/h2-17,22-24H,1H3