3-cyclohexyl-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-cyclohexyl-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-cyclohexyl-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-cyclohexyl-1-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-cyclohexyl-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-cyclohexyl-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]propan-1-one Formula: C21H32N2O5S MolecularWeight: 424.55418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3CCCCC3)OC

InChI

InChI=1S/C21H32N2O5S/c1-27-19-10-9-18(16-20(19)28-2)29(25,26)23-14-12-22(13-15-23)21(24)11-8-17-6-4-3-5-7-17/h9-10,16-17H,3-8,11-15H2,1-2H3