4-[4-(2,3-dihydro-1H-inden-2-yl)piperazin-1-yl]-2-[(1-oxidanylcyclohexyl)methyl]isoindole-1,3-dione

Systemtic Name: 4-[4-(2,3-dihydro-1H-inden-2-yl)piperazin-1-yl]-2-[(1-oxidanylcyclohexyl)methyl]isoindole-1,3-dione Openeye Name: 2-[(1-hydroxycyclohexyl)methyl]-4-(4-indan-2-ylpiperazin-1-yl)isoindoline-1,3-dione CAS Name: 4-[4-(2,3-dihydro-1H-inden-2-yl)-1-piperazinyl]-2-[(1-hydroxycyclohexyl)methyl]isoindole-1,3-dione IUPAC Name: 4-[4-(2,3-dihydro-1H-inden-2-yl)piperazin-1-yl]-2-[(1-hydroxycyclohexyl)methyl]isoindole-1,3-dione Traditional Name: 2-[(1-hydroxycyclohexyl)methyl]-4-(4-indan-2-ylpiperazino)isoindoline-1,3-quinone Formula: C28H33N3O3 MolecularWeight: 459.57992

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CN2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)C5CC6=CC=CC=C6C5)O

Isomeric SMILES

C1CCC(CC1)(CN2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)C5CC6=CC=CC=C6C5)O

InChI

InChI=1S/C28H33N3O3/c32-26-23-9-6-10-24(25(23)27(33)31(26)19-28(34)11-4-1-5-12-28)30-15-13-29(14-16-30)22-17-20-7-2-3-8-21(20)18-22/h2-3,6-10,22,34H,1,4-5,11-19H2