dimethyl 5-[4-(methylsulfonylamino)piperidin-1-yl]sulfonylbenzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[4-(methylsulfonylamino)piperidin-1-yl]sulfonylbenzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[4-(methanesulfonamido)-1-piperidyl]sulfonyl]benzene-1,3-dicarboxylate CAS Name: 5-[[4-(methanesulfonamido)-1-piperidinyl]sulfonyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[4-(methanesulfonamido)piperidin-1-yl]sulfonylbenzene-1,3-dicarboxylate Traditional Name: 5-[4-(methanesulfonamido)piperidino]sulfonylbenzene-1,3-dicarboxylic acid dimethyl ester Formula: C16H22N2O8S2 MolecularWeight: 434.48448

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)N2CCC(CC2)NS(=O)(=O)C)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)N2CCC(CC2)NS(=O)(=O)C)C(=O)OC

InChI

InChI=1S/C16H22N2O8S2/c1-25-15(19)11-8-12(16(20)26-2)10-14(9-11)28(23,24)18-6-4-13(5-7-18)17-27(3,21)22/h8-10,13,17H,4-7H2,1-3H3