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

Systemtic Name: [3-chloranyl-4-(1-propan-2-ylpiperidin-4-yl)oxy-phenyl] 2-sulfamoylethanoate dihydrochloride Openeye Name: [3-chloro-4-[(1-isopropyl-4-piperidyl)oxy]phenyl] 2-sulfamoylacetate dihydrochloride CAS Name: 2-sulfamoylacetic acid [3-chloro-4-[(1-propan-2-yl-4-piperidinyl)oxy]phenyl] ester dihydrochloride IUPAC Name: [3-chloro-4-(1-propan-2-ylpiperidin-4-yl)oxyphenyl] 2-sulfamoylacetate dihydrochloride Traditional Name: 2-sulfamoylacetic acid [3-chloro-4-[(1-isopropyl-4-piperidyl)oxy]phenyl] ester dihydrochloride Formula: C16H25Cl3N2O5S MolecularWeight: 463.8041

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)OC2=C(C=C(C=C2)OC(=O)CS(=O)(=O)N)Cl.Cl.Cl

Isomeric SMILES

CC(C)N1CCC(CC1)OC2=C(C=C(C=C2)OC(=O)CS(=O)(=O)N)Cl.Cl.Cl

InChI

InChI=1S/C16H23ClN2O5S.2ClH/c1-11(2)19-7-5-12(6-8-19)23-15-4-3-13(9-14(15)17)24-16(20)10-25(18,21)22;;/h3-4,9,11-12H,5-8,10H2,1-2H3,(H2,18,21,22);2*1H