(2,5-dimethoxyphenyl)-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (2,5-dimethoxyphenyl)-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-(2,5-dimethoxyphenyl)methanone CAS Name: (2,5-dimethoxyphenyl)-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-(2,5-dimethoxyphenyl)methanone Traditional Name: (4-benzylsulfonylpiperazino)-(2,5-dimethoxyphenyl)methanone Formula: C20H24N2O5S MolecularWeight: 404.47996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O5S/c1-26-17-8-9-19(27-2)18(14-17)20(23)21-10-12-22(13-11-21)28(24,25)15-16-6-4-3-5-7-16/h3-9,14H,10-13,15H2,1-2H3