6-[4-[3,3-bis(4-chlorophenyl)propyl]piperazin-1-yl]-2-cyclohexyl-3H-isoindol-1-one

Systemtic Name: 6-[4-[3,3-bis(4-chlorophenyl)propyl]piperazin-1-yl]-2-cyclohexyl-3H-isoindol-1-one Openeye Name: 6-[4-[3,3-bis(4-chlorophenyl)propyl]piperazin-1-yl]-2-cyclohexyl-isoindolin-1-one CAS Name: 6-[4-[3,3-bis(4-chlorophenyl)propyl]-1-piperazinyl]-2-cyclohexyl-3H-isoindol-1-one IUPAC Name: 6-[4-[3,3-bis(4-chlorophenyl)propyl]piperazin-1-yl]-2-cyclohexyl-3H-isoindol-1-one Traditional Name: 6-[4-[3,3-bis(4-chlorophenyl)propyl]piperazino]-2-cyclohexyl-isoindolin-1-one Formula: C33H37Cl2N3O MolecularWeight: 562.57238

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=C(C=C5)Cl)C6=CC=C(C=C6)Cl

Isomeric SMILES

C1CCC(CC1)N2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CCC(C5=CC=C(C=C5)Cl)C6=CC=C(C=C6)Cl

InChI

InChI=1S/C33H37Cl2N3O/c34-27-11-6-24(7-12-27)31(25-8-13-28(35)14-9-25)16-17-36-18-20-37(21-19-36)30-15-10-26-23-38(33(39)32(26)22-30)29-4-2-1-3-5-29/h6-15,22,29,31H,1-5,16-21,23H2