5,6-bis(5-methyl-2-propan-2-yl-cyclohexyl)-1,3-diphenyl-4,5,6,7-tetrahydro-2H-isoindole

Systemtic Name: 5,6-bis(5-methyl-2-propan-2-yl-cyclohexyl)-1,3-diphenyl-4,5,6,7-tetrahydro-2H-isoindole Openeye Name: 5,6-bis(2-isopropyl-5-methyl-cyclohexyl)-1,3-diphenyl-4,5,6,7-tetrahydro-2H-isoindole CAS Name: 5,6-bis(5-methyl-2-propan-2-ylcyclohexyl)-1,3-diphenyl-4,5,6,7-tetrahydro-2H-isoindole IUPAC Name: 5,6-bis(5-methyl-2-propan-2-ylcyclohexyl)-1,3-diphenyl-4,5,6,7-tetrahydro-2H-isoindole Traditional Name: 5,6-bis(2-isopropyl-5-methyl-cyclohexyl)-1,3-diphenyl-4,5,6,7-tetrahydro-2H-isoindole Formula: C40H55N MolecularWeight: 549.8714

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)C2CC3=C(NC(=C3CC2C4CC(CCC4C(C)C)C)C5=CC=CC=C5)C6=CC=CC=C6)C(C)C

Isomeric SMILES

CC1CCC(C(C1)C2CC3=C(NC(=C3CC2C4CC(CCC4C(C)C)C)C5=CC=CC=C5)C6=CC=CC=C6)C(C)C

InChI

InChI=1S/C40H55N/c1-25(2)31-19-17-27(5)21-33(31)35-23-37-38(24-36(35)34-22-28(6)18-20-32(34)26(3)4)40(30-15-11-8-12-16-30)41-39(37)29-13-9-7-10-14-29/h7-16,25-28,31-36,41H,17-24H2,1-6H3