1-cycloheptyl-3-(3,4-dimethoxyphenyl)-4-[(4-methylphenyl)methyl]piperazine-2,5-dione

Systemtic Name: 1-cycloheptyl-3-(3,4-dimethoxyphenyl)-4-[(4-methylphenyl)methyl]piperazine-2,5-dione Openeye Name: 1-cycloheptyl-3-(3,4-dimethoxyphenyl)-4-(p-tolylmethyl)piperazine-2,5-dione CAS Name: 1-cycloheptyl-3-(3,4-dimethoxyphenyl)-4-[(4-methylphenyl)methyl]piperazine-2,5-dione IUPAC Name: 1-cycloheptyl-3-(3,4-dimethoxyphenyl)-4-[(4-methylphenyl)methyl]piperazine-2,5-dione Traditional Name: 1-cycloheptyl-3-(3,4-dimethoxyphenyl)-4-(4-methylbenzyl)piperazine-2,5-quinone Formula: C27H34N2O4 MolecularWeight: 450.56986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(C(=O)N(CC2=O)C3CCCCCC3)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(C(=O)N(CC2=O)C3CCCCCC3)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H34N2O4/c1-19-10-12-20(13-11-19)17-29-25(30)18-28(22-8-6-4-5-7-9-22)27(31)26(29)21-14-15-23(32-2)24(16-21)33-3/h10-16,22,26H,4-9,17-18H2,1-3H3