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

Systemtic Name: 5-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]carbonyl-2-(2-methylphenyl)isoindole-1,3-dione Openeye Name: 5-[4-[(2,5-dimethoxyphenyl)methyl]piperazine-1-carbonyl]-2-(o-tolyl)isoindoline-1,3-dione CAS Name: 5-[[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]-oxomethyl]-2-(2-methylphenyl)isoindole-1,3-dione IUPAC Name: 5-[4-[(2,5-dimethoxyphenyl)methyl]piperazine-1-carbonyl]-2-(2-methylphenyl)isoindole-1,3-dione Traditional Name: 5-[4-(2,5-dimethoxybenzyl)piperazine-1-carbonyl]-2-(o-tolyl)isoindoline-1,3-quinone Formula: C29H29N3O5 MolecularWeight: 499.55766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)CC5=C(C=CC(=C5)OC)OC

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)CC5=C(C=CC(=C5)OC)OC

InChI

InChI=1S/C29H29N3O5/c1-19-6-4-5-7-25(19)32-28(34)23-10-8-20(17-24(23)29(32)35)27(33)31-14-12-30(13-15-31)18-21-16-22(36-2)9-11-26(21)37-3/h4-11,16-17H,12-15,18H2,1-3H3