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

Systemtic Name: 2-cyclohexyl-6-[4-(pyridin-3-ylmethyl)piperazin-1-yl]-3H-isoindol-1-one Openeye Name: 2-cyclohexyl-6-[4-(3-pyridylmethyl)piperazin-1-yl]isoindolin-1-one CAS Name: 2-cyclohexyl-6-[4-(3-pyridinylmethyl)-1-piperazinyl]-3H-isoindol-1-one IUPAC Name: 2-cyclohexyl-6-[4-(pyridin-3-ylmethyl)piperazin-1-yl]-3H-isoindol-1-one Traditional Name: 2-cyclohexyl-6-[4-(3-pyridylmethyl)piperazino]isoindolin-1-one Formula: C24H30N4O MolecularWeight: 390.5212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N4O/c29-24-23-15-22(9-8-20(23)18-28(24)21-6-2-1-3-7-21)27-13-11-26(12-14-27)17-19-5-4-10-25-16-19/h4-5,8-10,15-16,21H,1-3,6-7,11-14,17-18H2