1-cyclohexyl-4-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxyphenyl)piperazine-2,5-dione

Systemtic Name: 1-cyclohexyl-4-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxyphenyl)piperazine-2,5-dione Openeye Name: 1-cyclohexyl-4-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxyphenyl)piperazine-2,5-dione CAS Name: 1-cyclohexyl-4-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxyphenyl)piperazine-2,5-dione IUPAC Name: 1-cyclohexyl-4-[2-(3,4-dimethoxyphenyl)ethyl]-3-(3-methoxyphenyl)piperazine-2,5-dione Traditional Name: 1-cyclohexyl-4-homoveratryl-3-(3-methoxyphenyl)piperazine-2,5-quinone Formula: C27H34N2O5 MolecularWeight: 466.56926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(C(=O)N(CC2=O)C3CCCCC3)C4=CC(=CC=C4)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(C(=O)N(CC2=O)C3CCCCC3)C4=CC(=CC=C4)OC)OC

InChI

InChI=1S/C27H34N2O5/c1-32-22-11-7-8-20(17-22)26-27(31)29(21-9-5-4-6-10-21)18-25(30)28(26)15-14-19-12-13-23(33-2)24(16-19)34-3/h7-8,11-13,16-17,21,26H,4-6,9-10,14-15,18H2,1-3H3