4-[4-(5-methylsulfonyloxypentyl)piperidin-1-yl]sulfonyloxane-4-carboxylic acid

Systemtic Name: 4-[4-(5-methylsulfonyloxypentyl)piperidin-1-yl]sulfonyloxane-4-carboxylic acid Openeye Name: 4-[[4-(5-methylsulfonyloxypentyl)-1-piperidyl]sulfonyl]tetrahydropyran-4-carboxylic acid CAS Name: 4-[[4-(5-methylsulfonyloxypentyl)-1-piperidinyl]sulfonyl]-4-oxanecarboxylic acid IUPAC Name: 4-[4-(5-methylsulfonyloxypentyl)piperidin-1-yl]sulfonyloxane-4-carboxylic acid Traditional Name: 4-[4-(5-methylsulfonyloxypentyl)piperidino]sulfonyltetrahydropyran-4-carboxylic acid Formula: C17H31NO8S2 MolecularWeight: 441.55994

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCCCCC1CCN(CC1)S(=O)(=O)C2(CCOCC2)C(=O)O

Isomeric SMILES

CS(=O)(=O)OCCCCCC1CCN(CC1)S(=O)(=O)C2(CCOCC2)C(=O)O

InChI

InChI=1S/C17H31NO8S2/c1-27(21,22)26-12-4-2-3-5-15-6-10-18(11-7-15)28(23,24)17(16(19)20)8-13-25-14-9-17/h15H,2-14H2,1H3,(H,19,20)