[4-(1-butylpiperidin-4-yl)oxy-3-chloranyl-phenyl] 2-sulfamoylethanoate dihydrochloride

Systemtic Name: [4-(1-butylpiperidin-4-yl)oxy-3-chloranyl-phenyl] 2-sulfamoylethanoate dihydrochloride Openeye Name: [4-[(1-butyl-4-piperidyl)oxy]-3-chloro-phenyl] 2-sulfamoylacetate dihydrochloride CAS Name: 2-sulfamoylacetic acid [4-[(1-butyl-4-piperidinyl)oxy]-3-chlorophenyl] ester dihydrochloride IUPAC Name: [4-(1-butylpiperidin-4-yl)oxy-3-chlorophenyl] 2-sulfamoylacetate dihydrochloride Traditional Name: 2-sulfamoylacetic acid [4-[(1-butyl-4-piperidyl)oxy]-3-chloro-phenyl] ester dihydrochloride Formula: C17H27Cl3N2O5S MolecularWeight: 477.83068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)OC2=C(C=C(C=C2)OC(=O)CS(=O)(=O)N)Cl.Cl.Cl

Isomeric SMILES

CCCCN1CCC(CC1)OC2=C(C=C(C=C2)OC(=O)CS(=O)(=O)N)Cl.Cl.Cl

InChI

InChI=1S/C17H25ClN2O5S.2ClH/c1-2-3-8-20-9-6-13(7-10-20)24-16-5-4-14(11-15(16)18)25-17(21)12-26(19,22)23;;/h4-5,11,13H,2-3,6-10,12H2,1H3,(H2,19,22,23);2*1H