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

Systemtic Name: 4-[4-(1-pentylpiperidin-4-yl)piperidin-1-yl]sulfonyloxane-4-carboxylic acid Openeye Name: 4-[[4-(1-pentyl-4-piperidyl)-1-piperidyl]sulfonyl]tetrahydropyran-4-carboxylic acid CAS Name: 4-[[4-(1-pentyl-4-piperidinyl)-1-piperidinyl]sulfonyl]-4-oxanecarboxylic acid IUPAC Name: 4-[4-(1-pentylpiperidin-4-yl)piperidin-1-yl]sulfonyloxane-4-carboxylic acid Traditional Name: 4-[4-(1-amyl-4-piperidyl)piperidino]sulfonyltetrahydropyran-4-carboxylic acid Formula: C21H38N2O5S MolecularWeight: 430.60182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CCC(CC1)C2CCN(CC2)S(=O)(=O)C3(CCOCC3)C(=O)O

Isomeric SMILES

CCCCCN1CCC(CC1)C2CCN(CC2)S(=O)(=O)C3(CCOCC3)C(=O)O

InChI

InChI=1S/C21H38N2O5S/c1-2-3-4-11-22-12-5-18(6-13-22)19-7-14-23(15-8-19)29(26,27)21(20(24)25)9-16-28-17-10-21/h18-19H,2-17H2,1H3,(H,24,25)