[4-(4-chloranylphenoxy)piperidin-1-yl]sulfonylmethyl 2-ethyloxane-4-carboxylate

Systemtic Name: [4-(4-chloranylphenoxy)piperidin-1-yl]sulfonylmethyl 2-ethyloxane-4-carboxylate Openeye Name: [4-(4-chlorophenoxy)-1-piperidyl]sulfonylmethyl 2-ethyltetrahydropyran-4-carboxylate CAS Name: 2-ethyl-4-oxanecarboxylic acid [4-(4-chlorophenoxy)-1-piperidinyl]sulfonylmethyl ester IUPAC Name: [4-(4-chlorophenoxy)piperidin-1-yl]sulfonylmethyl 2-ethyloxane-4-carboxylate Traditional Name: 2-ethyltetrahydropyran-4-carboxylic acid [4-(4-chlorophenoxy)piperidino]sulfonylmethyl ester Formula: C20H28ClNO6S MolecularWeight: 445.95742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(CCO1)C(=O)OCS(=O)(=O)N2CCC(CC2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CCC1CC(CCO1)C(=O)OCS(=O)(=O)N2CCC(CC2)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H28ClNO6S/c1-2-17-13-15(9-12-26-17)20(23)27-14-29(24,25)22-10-7-19(8-11-22)28-18-5-3-16(21)4-6-18/h3-6,15,17,19H,2,7-14H2,1H3