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

Systemtic Name: 3-(4-chlorophenyl)-1-cycloheptyl-4-[2-(cyclohexen-1-yl)ethyl]piperazine-2,5-dione Openeye Name: 3-(4-chlorophenyl)-1-cycloheptyl-4-[2-(cyclohexen-1-yl)ethyl]piperazine-2,5-dione CAS Name: 3-(4-chlorophenyl)-1-cycloheptyl-4-[2-(1-cyclohexenyl)ethyl]piperazine-2,5-dione IUPAC Name: 3-(4-chlorophenyl)-1-cycloheptyl-4-[2-(cyclohexen-1-yl)ethyl]piperazine-2,5-dione Traditional Name: 3-(4-chlorophenyl)-1-cycloheptyl-4-[2-(cyclohexen-1-yl)ethyl]piperazine-2,5-quinone Formula: C25H33ClN2O2 MolecularWeight: 428.99472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N2CC(=O)N(C(C2=O)C3=CC=C(C=C3)Cl)CCC4=CCCCC4

Isomeric SMILES

C1CCCC(CC1)N2CC(=O)N(C(C2=O)C3=CC=C(C=C3)Cl)CCC4=CCCCC4

InChI

InChI=1S/C25H33ClN2O2/c26-21-14-12-20(13-15-21)24-25(30)28(22-10-6-1-2-7-11-22)18-23(29)27(24)17-16-19-8-4-3-5-9-19/h8,12-15,22,24H,1-7,9-11,16-18H2