4-cyclohexyl-N-(furan-2-ylmethyl)-N-(1-methylpiperidin-1-ium-4-yl)benzenesulfonamide

Systemtic Name: 4-cyclohexyl-N-(furan-2-ylmethyl)-N-(1-methylpiperidin-1-ium-4-yl)benzenesulfonamide Openeye Name: 4-cyclohexyl-N-(2-furylmethyl)-N-(1-methylpiperidin-1-ium-4-yl)benzenesulfonamide CAS Name: 4-cyclohexyl-N-(2-furanylmethyl)-N-(1-methyl-4-piperidin-1-iumyl)benzenesulfonamide IUPAC Name: 4-cyclohexyl-N-(furan-2-ylmethyl)-N-(1-methylpiperidin-1-ium-4-yl)benzenesulfonamide Traditional Name: 4-cyclohexyl-N-(2-furfuryl)-N-(1-methylpiperidin-1-ium-4-yl)benzenesulfonamide Formula: C23H33N2O3S+ MolecularWeight: 417.58472

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(CC2=CC=CO2)S(=O)(=O)C3=CC=C(C=C3)C4CCCCC4

Isomeric SMILES

C[NH+]1CCC(CC1)N(CC2=CC=CO2)S(=O)(=O)C3=CC=C(C=C3)C4CCCCC4

InChI

InChI=1S/C23H32N2O3S/c1-24-15-13-21(14-16-24)25(18-22-8-5-17-28-22)29(26,27)23-11-9-20(10-12-23)19-6-3-2-4-7-19/h5,8-12,17,19,21H,2-4,6-7,13-16,18H2,1H3/p+1