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

Systemtic Name: 2-[(3,4-dimethoxyphenyl)methyl]-4-[4-(2-methylpropyl)piperazin-1-yl]isoindole-1,3-dione Openeye Name: 2-[(3,4-dimethoxyphenyl)methyl]-4-(4-isobutylpiperazin-1-yl)isoindoline-1,3-dione CAS Name: 2-[(3,4-dimethoxyphenyl)methyl]-4-[4-(2-methylpropyl)-1-piperazinyl]isoindole-1,3-dione IUPAC Name: 2-[(3,4-dimethoxyphenyl)methyl]-4-[4-(2-methylpropyl)piperazin-1-yl]isoindole-1,3-dione Traditional Name: 4-(4-isobutylpiperazino)-2-veratryl-isoindoline-1,3-quinone Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCN(CC1)C2=CC=CC3=C2C(=O)N(C3=O)CC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(C)CN1CCN(CC1)C2=CC=CC3=C2C(=O)N(C3=O)CC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C25H31N3O4/c1-17(2)15-26-10-12-27(13-11-26)20-7-5-6-19-23(20)25(30)28(24(19)29)16-18-8-9-21(31-3)22(14-18)32-4/h5-9,14,17H,10-13,15-16H2,1-4H3