3-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-2-cyclohexyl-3H-isoindol-1-one

Systemtic Name: 3-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-2-cyclohexyl-3H-isoindol-1-one Openeye Name: 3-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-2-cyclohexyl-isoindolin-1-one CAS Name: 3-[4-[(2-chlorophenyl)methyl]-1-piperazinyl]-2-cyclohexyl-3H-isoindol-1-one IUPAC Name: 3-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-2-cyclohexyl-3H-isoindol-1-one Traditional Name: 3-[4-(2-chlorobenzyl)piperazino]-2-cyclohexyl-isoindolin-1-one Formula: C25H30ClN3O MolecularWeight: 423.9782

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(C3=CC=CC=C3C2=O)N4CCN(CC4)CC5=CC=CC=C5Cl

Isomeric SMILES

C1CCC(CC1)N2C(C3=CC=CC=C3C2=O)N4CCN(CC4)CC5=CC=CC=C5Cl

InChI

InChI=1S/C25H30ClN3O/c26-23-13-7-4-8-19(23)18-27-14-16-28(17-15-27)24-21-11-5-6-12-22(21)25(30)29(24)20-9-2-1-3-10-20/h4-8,11-13,20,24H,1-3,9-10,14-18H2