2-[[4-(1-butylpiperidin-4-yl)oxy-2-methyl-phenyl]sulfamoyl]ethanesulfonic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)OC2=CC(=C(C=C2)NS(=O)(=O)CCS(=O)(=O)O)C

Isomeric SMILES

CCCCN1CCC(CC1)OC2=CC(=C(C=C2)NS(=O)(=O)CCS(=O)(=O)O)C

InChI

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