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

Systemtic Name: 2-methyl-5-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]carbonyl-isoindole-1,3-dione Openeye Name: 2-methyl-5-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carbonyl]isoindoline-1,3-dione CAS Name: 2-methyl-5-[oxo-[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinyl]methyl]isoindole-1,3-dione IUPAC Name: 2-methyl-5-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carbonyl]isoindole-1,3-dione Traditional Name: 2-methyl-5-[4-(2,3,4-trimethoxybenzyl)piperazine-1-carbonyl]isoindoline-1,3-quinone Formula: C24H27N3O6 MolecularWeight: 453.48768

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)CC4=C(C(=C(C=C4)OC)OC)OC

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)CC4=C(C(=C(C=C4)OC)OC)OC

InChI

InChI=1S/C24H27N3O6/c1-25-23(29)17-7-5-15(13-18(17)24(25)30)22(28)27-11-9-26(10-12-27)14-16-6-8-19(31-2)21(33-4)20(16)32-3/h5-8,13H,9-12,14H2,1-4H3