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

Systemtic Name: 5-[4-[(2-methylphenyl)methyl]piperazin-1-yl]carbonyl-2-(oxolan-2-ylmethyl)isoindole-1,3-dione Openeye Name: 5-[4-(o-tolylmethyl)piperazine-1-carbonyl]-2-(tetrahydrofuran-2-ylmethyl)isoindoline-1,3-dione CAS Name: 5-[[4-[(2-methylphenyl)methyl]-1-piperazinyl]-oxomethyl]-2-(2-oxolanylmethyl)isoindole-1,3-dione IUPAC Name: 5-[4-[(2-methylphenyl)methyl]piperazine-1-carbonyl]-2-(oxolan-2-ylmethyl)isoindole-1,3-dione Traditional Name: 5-[4-(2-methylbenzyl)piperazine-1-carbonyl]-2-(tetrahydrofurfuryl)isoindoline-1,3-quinone Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5CCCO5

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5CCCO5

InChI

InChI=1S/C26H29N3O4/c1-18-5-2-3-6-20(18)16-27-10-12-28(13-11-27)24(30)19-8-9-22-23(15-19)26(32)29(25(22)31)17-21-7-4-14-33-21/h2-3,5-6,8-9,15,21H,4,7,10-14,16-17H2,1H3