N,N-diethyl-4-(piperidin-1-ium-4-ylmethyl)benzenesulfonamide

Systemtic Name: N,N-diethyl-4-(piperidin-1-ium-4-ylmethyl)benzenesulfonamide Openeye Name: N,N-diethyl-4-(piperidin-1-ium-4-ylmethyl)benzenesulfonamide CAS Name: N,N-diethyl-4-(4-piperidin-1-iumylmethyl)benzenesulfonamide IUPAC Name: N,N-diethyl-4-(piperidin-1-ium-4-ylmethyl)benzenesulfonamide Traditional Name: N,N-diethyl-4-(piperidin-1-ium-4-ylmethyl)benzenesulfonamide Formula: C16H27N2O2S+ MolecularWeight: 311.46278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O2S/c1-3-18(4-2)21(19,20)16-7-5-14(6-8-16)13-15-9-11-17-12-10-15/h5-8,15,17H,3-4,9-13H2,1-2H3/p+1