1-cycloheptyl-4-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxy-4-propan-2-yloxy-phenyl)piperazine-2,5-dione

Systemtic Name: 1-cycloheptyl-4-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxy-4-propan-2-yloxy-phenyl)piperazine-2,5-dione Openeye Name: 1-cycloheptyl-4-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-isopropoxy-3-methoxy-phenyl)piperazine-2,5-dione CAS Name: 1-cycloheptyl-4-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxy-4-propan-2-yloxyphenyl)piperazine-2,5-dione IUPAC Name: 1-cycloheptyl-4-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxy-4-propan-2-yloxyphenyl)piperazine-2,5-dione Traditional Name: 1-cycloheptyl-4-homoveratryl-3-(4-isopropoxy-3-methoxy-phenyl)piperazine-2,5-quinone Formula: C31H42N2O6 MolecularWeight: 538.67498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CCC3=CC(=C(C=C3)OC)OC)C4CCCCCC4)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CCC3=CC(=C(C=C3)OC)OC)C4CCCCCC4)OC

InChI

InChI=1S/C31H42N2O6/c1-21(2)39-26-15-13-23(19-28(26)38-5)30-31(35)33(24-10-8-6-7-9-11-24)20-29(34)32(30)17-16-22-12-14-25(36-3)27(18-22)37-4/h12-15,18-19,21,24,30H,6-11,16-17,20H2,1-5H3