2-(oxolan-2-ylmethyl)-4-[4-(quinolin-8-ylmethyl)piperazin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-(oxolan-2-ylmethyl)-4-[4-(quinolin-8-ylmethyl)piperazin-1-yl]isoindole-1,3-dione Openeye Name: 4-[4-(8-quinolylmethyl)piperazin-1-yl]-2-(tetrahydrofuran-2-ylmethyl)isoindoline-1,3-dione CAS Name: 2-(2-oxolanylmethyl)-4-[4-(8-quinolinylmethyl)-1-piperazinyl]isoindole-1,3-dione IUPAC Name: 2-(oxolan-2-ylmethyl)-4-[4-(quinolin-8-ylmethyl)piperazin-1-yl]isoindole-1,3-dione Traditional Name: 4-[4-(8-quinolylmethyl)piperazino]-2-(tetrahydrofurfuryl)isoindoline-1,3-quinone Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)CC5=CC=CC6=C5N=CC=C6

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)CC5=CC=CC6=C5N=CC=C6

InChI

InChI=1S/C27H28N4O3/c32-26-22-9-2-10-23(24(22)27(33)31(26)18-21-8-4-16-34-21)30-14-12-29(13-15-30)17-20-6-1-5-19-7-3-11-28-25(19)20/h1-3,5-7,9-11,21H,4,8,12-18H2