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

Systemtic Name: 6-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-cyclohexyl-3H-isoindol-1-one Openeye Name: 6-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-cyclohexyl-isoindolin-1-one CAS Name: 6-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-cyclohexyl-3H-isoindol-1-one IUPAC Name: 6-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-cyclohexyl-3H-isoindol-1-one Traditional Name: 6-[4-(4-chlorobenzyl)piperazino]-2-cyclohexyl-isoindolin-1-one Formula: C25H30ClN3O MolecularWeight: 423.9782

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCC(CC1)N2CC3=C(C2=O)C=C(C=C3)N4CCN(CC4)CC5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H30ClN3O/c26-21-9-6-19(7-10-21)17-27-12-14-28(15-13-27)23-11-8-20-18-29(25(30)24(20)16-23)22-4-2-1-3-5-22/h6-11,16,22H,1-5,12-15,17-18H2