N-butyl-N-methyl-4-(piperidin-1-ium-4-ylmethyl)benzenesulfonamide

Systemtic Name: N-butyl-N-methyl-4-(piperidin-1-ium-4-ylmethyl)benzenesulfonamide Openeye Name: N-butyl-N-methyl-4-(piperidin-1-ium-4-ylmethyl)benzenesulfonamide CAS Name: N-butyl-N-methyl-4-(4-piperidin-1-iumylmethyl)benzenesulfonamide IUPAC Name: N-butyl-N-methyl-4-(piperidin-1-ium-4-ylmethyl)benzenesulfonamide Traditional Name: N-butyl-N-methyl-4-(piperidin-1-ium-4-ylmethyl)benzenesulfonamide Formula: C17H29N2O2S+ MolecularWeight: 325.48936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)CC2CC[NH2+]CC2

Isomeric SMILES

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)CC2CC[NH2+]CC2

InChI

InChI=1S/C17H28N2O2S/c1-3-4-13-19(2)22(20,21)17-7-5-15(6-8-17)14-16-9-11-18-12-10-16/h5-8,16,18H,3-4,9-14H2,1-2H3/p+1