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

Systemtic Name: 2-(oxolan-2-ylmethyl)-4-[3-(4-phenylpiperazin-1-yl)carbonylpiperidin-1-yl]isoindole-1,3-dione Openeye Name: 4-[3-(4-phenylpiperazine-1-carbonyl)-1-piperidyl]-2-(tetrahydrofuran-2-ylmethyl)isoindoline-1,3-dione CAS Name: 2-(2-oxolanylmethyl)-4-[3-[oxo-(4-phenyl-1-piperazinyl)methyl]-1-piperidinyl]isoindole-1,3-dione IUPAC Name: 2-(oxolan-2-ylmethyl)-4-[3-(4-phenylpiperazine-1-carbonyl)piperidin-1-yl]isoindole-1,3-dione Traditional Name: 4-[3-(4-phenylpiperazine-1-carbonyl)piperidino]-2-(tetrahydrofurfuryl)isoindoline-1,3-quinone Formula: C29H34N4O4 MolecularWeight: 502.60466

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CC=CC3=C2C(=O)N(C3=O)CC4CCCO4)C(=O)N5CCN(CC5)C6=CC=CC=C6

Isomeric SMILES

C1CC(CN(C1)C2=CC=CC3=C2C(=O)N(C3=O)CC4CCCO4)C(=O)N5CCN(CC5)C6=CC=CC=C6

InChI

InChI=1S/C29H34N4O4/c34-27(31-16-14-30(15-17-31)22-8-2-1-3-9-22)21-7-5-13-32(19-21)25-12-4-11-24-26(25)29(36)33(28(24)35)20-23-10-6-18-37-23/h1-4,8-9,11-12,21,23H,5-7,10,13-20H2