2-[2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]-1-piperazinyl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazin-1-yl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[4-(4,5-dimethoxy-2-methyl-benzyl)piperazino]ethyl]isoindoline-1,3-quinone Formula: C24H29N3O4 MolecularWeight: 423.50476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CCN(CC2)CCN3C(=O)C4=CC=CC=C4C3=O)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CCN(CC2)CCN3C(=O)C4=CC=CC=C4C3=O)OC)OC

InChI

InChI=1S/C24H29N3O4/c1-17-14-21(30-2)22(31-3)15-18(17)16-26-10-8-25(9-11-26)12-13-27-23(28)19-6-4-5-7-20(19)24(27)29/h4-7,14-15H,8-13,16H2,1-3H3