2-phenyl-N-[[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]methyl]ethanesulfonamide

Systemtic Name: 2-phenyl-N-[[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]methyl]ethanesulfonamide Openeye Name: 2-phenyl-N-[[1-(2-thienylmethyl)piperidin-1-ium-4-yl]methyl]ethanesulfonamide CAS Name: 2-phenyl-N-[[1-(thiophen-2-ylmethyl)-4-piperidin-1-iumyl]methyl]ethanesulfonamide IUPAC Name: 2-phenyl-N-[[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]methyl]ethanesulfonamide Traditional Name: 2-phenyl-N-[[1-(2-thenyl)piperidin-1-ium-4-yl]methyl]ethanesulfonamide Formula: C19H27N2O2S2+ MolecularWeight: 379.55988

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CNS(=O)(=O)CCC2=CC=CC=C2)CC3=CC=CS3

Isomeric SMILES

C1C[NH+](CCC1CNS(=O)(=O)CCC2=CC=CC=C2)CC3=CC=CS3

InChI

InChI=1S/C19H26N2O2S2/c22-25(23,14-10-17-5-2-1-3-6-17)20-15-18-8-11-21(12-9-18)16-19-7-4-13-24-19/h1-7,13,18,20H,8-12,14-16H2/p+1