2-(3-chlorophenyl)-4-[4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-(3-chlorophenyl)-4-[4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]isoindole-1,3-dione Openeye Name: 2-(3-chlorophenyl)-4-[4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]isoindoline-1,3-dione CAS Name: 2-(3-chlorophenyl)-4-[4-(1-cyclohex-3-enylmethyl)-1-piperazinyl]isoindole-1,3-dione IUPAC Name: 2-(3-chlorophenyl)-4-[4-(cyclohex-3-en-1-ylmethyl)piperazin-1-yl]isoindole-1,3-dione Traditional Name: 2-(3-chlorophenyl)-4-[4-(cyclohex-3-en-1-ylmethyl)piperazino]isoindoline-1,3-quinone Formula: C25H26ClN3O2 MolecularWeight: 435.94584

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)CN2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CC(CC=C1)CN2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C25H26ClN3O2/c26-19-8-4-9-20(16-19)29-24(30)21-10-5-11-22(23(21)25(29)31)28-14-12-27(13-15-28)17-18-6-2-1-3-7-18/h1-2,4-5,8-11,16,18H,3,6-7,12-15,17H2