2-(1-butylpiperidin-4-yl)oxy-2-(2-methylphenyl)-2-sulfamoyl-ethanesulfonic acid

Systemtic Name: 2-(1-butylpiperidin-4-yl)oxy-2-(2-methylphenyl)-2-sulfamoyl-ethanesulfonic acid Openeye Name: 2-[(1-butyl-4-piperidyl)oxy]-2-(o-tolyl)-2-sulfamoyl-ethanesulfonic acid CAS Name: 2-[(1-butyl-4-piperidinyl)oxy]-2-(2-methylphenyl)-2-sulfamoylethanesulfonic acid IUPAC Name: 2-(1-butylpiperidin-4-yl)oxy-2-(2-methylphenyl)-2-sulfamoylethanesulfonic acid Traditional Name: 2-[(1-butyl-4-piperidyl)oxy]-2-(o-tolyl)-2-sulfamoyl-ethanesulfonic acid Formula: C18H30N2O6S2 MolecularWeight: 434.5706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)OC(CS(=O)(=O)O)(C2=CC=CC=C2C)S(=O)(=O)N

Isomeric SMILES

CCCCN1CCC(CC1)OC(CS(=O)(=O)O)(C2=CC=CC=C2C)S(=O)(=O)N

InChI

InChI=1S/C18H30N2O6S2/c1-3-4-11-20-12-9-16(10-13-20)26-18(28(19,24)25,14-27(21,22)23)17-8-6-5-7-15(17)2/h5-8,16H,3-4,9-14H2,1-2H3,(H2,19,24,25)(H,21,22,23)