2-(2,3-dimethylcyclohexyl)-4,7-diphenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-(2,3-dimethylcyclohexyl)-4,7-diphenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-(2,3-dimethylcyclohexyl)-4,7-diphenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-(2,3-dimethylcyclohexyl)-4,7-diphenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(2,3-dimethylcyclohexyl)-4,7-diphenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-(2,3-dimethylcyclohexyl)-4,7-diphenyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C28H31NO2 MolecularWeight: 413.55124

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)N2C(=O)C3C(C=CC(C3C2=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1CCCC(C1C)N2C(=O)C3C(C=CC(C3C2=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H31NO2/c1-18-10-9-15-24(19(18)2)29-27(30)25-22(20-11-5-3-6-12-20)16-17-23(26(25)28(29)31)21-13-7-4-8-14-21/h3-8,11-14,16-19,22-26H,9-10,15H2,1-2H3