2-[(2,3-dimethoxyphenyl)methyl]-4-[4-(2-ethanoylphenyl)carbonylpiperazin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-[(2,3-dimethoxyphenyl)methyl]-4-[4-(2-ethanoylphenyl)carbonylpiperazin-1-yl]isoindole-1,3-dione Openeye Name: 4-[4-(2-acetylbenzoyl)piperazin-1-yl]-2-[(2,3-dimethoxyphenyl)methyl]isoindoline-1,3-dione CAS Name: 4-[4-[(2-acetylphenyl)-oxomethyl]-1-piperazinyl]-2-[(2,3-dimethoxyphenyl)methyl]isoindole-1,3-dione IUPAC Name: 4-[4-(2-acetylbenzoyl)piperazin-1-yl]-2-[(2,3-dimethoxyphenyl)methyl]isoindole-1,3-dione Traditional Name: 4-[4-(2-acetylbenzoyl)piperazino]-2-o-veratryl-isoindoline-1,3-quinone Formula: C30H29N3O6 MolecularWeight: 527.56776

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CC5=C(C(=CC=C5)OC)OC

Isomeric SMILES

CC(=O)C1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CC5=C(C(=CC=C5)OC)OC

InChI

InChI=1S/C30H29N3O6/c1-19(34)21-9-4-5-10-22(21)28(35)32-16-14-31(15-17-32)24-12-7-11-23-26(24)30(37)33(29(23)36)18-20-8-6-13-25(38-2)27(20)39-3/h4-13H,14-18H2,1-3H3