5-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]carbonyl-2-(oxolan-2-ylmethyl)isoindole-1,3-dione

Systemtic Name: 5-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]carbonyl-2-(oxolan-2-ylmethyl)isoindole-1,3-dione Openeye Name: 5-[4-[(3-chlorophenyl)methyl]piperazine-1-carbonyl]-2-(tetrahydrofuran-2-ylmethyl)isoindoline-1,3-dione CAS Name: 5-[[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-oxomethyl]-2-(2-oxolanylmethyl)isoindole-1,3-dione IUPAC Name: 5-[4-[(3-chlorophenyl)methyl]piperazine-1-carbonyl]-2-(oxolan-2-ylmethyl)isoindole-1,3-dione Traditional Name: 5-[4-(3-chlorobenzyl)piperazine-1-carbonyl]-2-(tetrahydrofurfuryl)isoindoline-1,3-quinone Formula: C25H26ClN3O4 MolecularWeight: 467.94464

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)CC5=CC(=CC=C5)Cl

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)CC5=CC(=CC=C5)Cl

InChI

InChI=1S/C25H26ClN3O4/c26-19-4-1-3-17(13-19)15-27-8-10-28(11-9-27)23(30)18-6-7-21-22(14-18)25(32)29(24(21)31)16-20-5-2-12-33-20/h1,3-4,6-7,13-14,20H,2,5,8-12,15-16H2