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

Systemtic Name: 3-(4-chlorophenyl)-1-cycloheptyl-4-[(2-methoxyphenyl)methyl]piperazine-2,5-dione Openeye Name: 3-(4-chlorophenyl)-1-cycloheptyl-4-[(2-methoxyphenyl)methyl]piperazine-2,5-dione CAS Name: 3-(4-chlorophenyl)-1-cycloheptyl-4-[(2-methoxyphenyl)methyl]piperazine-2,5-dione IUPAC Name: 3-(4-chlorophenyl)-1-cycloheptyl-4-[(2-methoxyphenyl)methyl]piperazine-2,5-dione Traditional Name: 3-(4-chlorophenyl)-1-cycloheptyl-4-o-anisyl-piperazine-2,5-quinone Formula: C25H29ClN2O3 MolecularWeight: 440.96236

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2C(C(=O)N(CC2=O)C3CCCCCC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=CC=C1CN2C(C(=O)N(CC2=O)C3CCCCCC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H29ClN2O3/c1-31-22-11-7-6-8-19(22)16-28-23(29)17-27(21-9-4-2-3-5-10-21)25(30)24(28)18-12-14-20(26)15-13-18/h6-8,11-15,21,24H,2-5,9-10,16-17H2,1H3