1-cyclohexyl-3-(3,4-dimethoxyphenyl)-4-phenethyl-piperazine-2,5-dione

Systemtic Name: 1-cyclohexyl-3-(3,4-dimethoxyphenyl)-4-phenethyl-piperazine-2,5-dione Openeye Name: 1-cyclohexyl-3-(3,4-dimethoxyphenyl)-4-phenethyl-piperazine-2,5-dione CAS Name: 1-cyclohexyl-3-(3,4-dimethoxyphenyl)-4-phenethylpiperazine-2,5-dione IUPAC Name: 1-cyclohexyl-3-(3,4-dimethoxyphenyl)-4-phenethylpiperazine-2,5-dione Traditional Name: 1-cyclohexyl-3-(3,4-dimethoxyphenyl)-4-phenethyl-piperazine-2,5-quinone Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CCC3=CC=CC=C3)C4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CCC3=CC=CC=C3)C4CCCCC4)OC

InChI

InChI=1S/C26H32N2O4/c1-31-22-14-13-20(17-23(22)32-2)25-26(30)28(21-11-7-4-8-12-21)18-24(29)27(25)16-15-19-9-5-3-6-10-19/h3,5-6,9-10,13-14,17,21,25H,4,7-8,11-12,15-16,18H2,1-2H3