2-(oxolan-2-ylmethyl)-4-[3-[4-(phenylmethyl)piperidin-1-yl]carbonylpiperidin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-(oxolan-2-ylmethyl)-4-[3-[4-(phenylmethyl)piperidin-1-yl]carbonylpiperidin-1-yl]isoindole-1,3-dione Openeye Name: 4-[3-(4-benzylpiperidine-1-carbonyl)-1-piperidyl]-2-(tetrahydrofuran-2-ylmethyl)isoindoline-1,3-dione CAS Name: 2-(2-oxolanylmethyl)-4-[3-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-1-piperidinyl]isoindole-1,3-dione IUPAC Name: 4-[3-(4-benzylpiperidine-1-carbonyl)piperidin-1-yl]-2-(oxolan-2-ylmethyl)isoindole-1,3-dione Traditional Name: 4-[3-(4-benzylpiperidine-1-carbonyl)piperidino]-2-(tetrahydrofurfuryl)isoindoline-1,3-quinone Formula: C31H37N3O4 MolecularWeight: 515.64318

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CC=CC3=C2C(=O)N(C3=O)CC4CCCO4)C(=O)N5CCC(CC5)CC6=CC=CC=C6

Isomeric SMILES

C1CC(CN(C1)C2=CC=CC3=C2C(=O)N(C3=O)CC4CCCO4)C(=O)N5CCC(CC5)CC6=CC=CC=C6

InChI

InChI=1S/C31H37N3O4/c35-29(32-16-13-23(14-17-32)19-22-7-2-1-3-8-22)24-9-5-15-33(20-24)27-12-4-11-26-28(27)31(37)34(30(26)36)21-25-10-6-18-38-25/h1-4,7-8,11-12,23-25H,5-6,9-10,13-21H2