2-cycloheptyl-4-[4-[4-(2,5-dimethoxyphenyl)carbonylphenyl]carbonylpiperazin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-cycloheptyl-4-[4-[4-(2,5-dimethoxyphenyl)carbonylphenyl]carbonylpiperazin-1-yl]isoindole-1,3-dione Openeye Name: 2-cycloheptyl-4-[4-[4-(2,5-dimethoxybenzoyl)benzoyl]piperazin-1-yl]isoindoline-1,3-dione CAS Name: 2-cycloheptyl-4-[4-[[4-[(2,5-dimethoxyphenyl)-oxomethyl]phenyl]-oxomethyl]-1-piperazinyl]isoindole-1,3-dione IUPAC Name: 2-cycloheptyl-4-[4-[4-(2,5-dimethoxybenzoyl)benzoyl]piperazin-1-yl]isoindole-1,3-dione Traditional Name: 2-cycloheptyl-4-[4-[4-(2,5-dimethoxybenzoyl)benzoyl]piperazino]isoindoline-1,3-quinone Formula: C35H37N3O6 MolecularWeight: 595.68478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC5=C4C(=O)N(C5=O)C6CCCCCC6

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC5=C4C(=O)N(C5=O)C6CCCCCC6

InChI

InChI=1S/C35H37N3O6/c1-43-26-16-17-30(44-2)28(22-26)32(39)23-12-14-24(15-13-23)33(40)37-20-18-36(19-21-37)29-11-7-10-27-31(29)35(42)38(34(27)41)25-8-5-3-4-6-9-25/h7,10-17,22,25H,3-6,8-9,18-21H2,1-2H3