4-[2-(4-chlorophenyl)ethyl]-1-cycloheptyl-3-(4-methoxyphenyl)piperazine-2,5-dione

Systemtic Name: 4-[2-(4-chlorophenyl)ethyl]-1-cycloheptyl-3-(4-methoxyphenyl)piperazine-2,5-dione Openeye Name: 4-[2-(4-chlorophenyl)ethyl]-1-cycloheptyl-3-(4-methoxyphenyl)piperazine-2,5-dione CAS Name: 4-[2-(4-chlorophenyl)ethyl]-1-cycloheptyl-3-(4-methoxyphenyl)piperazine-2,5-dione IUPAC Name: 4-[2-(4-chlorophenyl)ethyl]-1-cycloheptyl-3-(4-methoxyphenyl)piperazine-2,5-dione Traditional Name: 4-[2-(4-chlorophenyl)ethyl]-1-cycloheptyl-3-(4-methoxyphenyl)piperazine-2,5-quinone Formula: C26H31ClN2O3 MolecularWeight: 454.98894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(=O)N(CC(=O)N2CCC3=CC=C(C=C3)Cl)C4CCCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2C(=O)N(CC(=O)N2CCC3=CC=C(C=C3)Cl)C4CCCCCC4

InChI

InChI=1S/C26H31ClN2O3/c1-32-23-14-10-20(11-15-23)25-26(31)29(22-6-4-2-3-5-7-22)18-24(30)28(25)17-16-19-8-12-21(27)13-9-19/h8-15,22,25H,2-7,16-18H2,1H3