(5-methylsulfonylthiophen-2-yl)-(1-piperidin-1-ylpiperidin-1-ium-1-yl)methanone

Systemtic Name: (5-methylsulfonylthiophen-2-yl)-(1-piperidin-1-ylpiperidin-1-ium-1-yl)methanone Openeye Name: (5-methylsulfonyl-2-thienyl)-[1-(1-piperidyl)piperidin-1-ium-1-yl]methanone CAS Name: (5-methylsulfonyl-2-thiophenyl)-[1-(1-piperidinyl)-1-piperidin-1-iumyl]methanone IUPAC Name: (5-methylsulfonylthiophen-2-yl)-(1-piperidin-1-ylpiperidin-1-ium-1-yl)methanone Traditional Name: (5-mesyl-2-thienyl)-(1-piperidinopiperidin-1-ium-1-yl)methanone Formula: C16H25N2O3S2+ MolecularWeight: 357.5113

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(S1)C(=O)[N+]2(CCCCC2)N3CCCCC3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(S1)C(=O)[N+]2(CCCCC2)N3CCCCC3

InChI

InChI=1S/C16H25N2O3S2/c1-23(20,21)15-9-8-14(22-15)16(19)18(12-6-3-7-13-18)17-10-4-2-5-11-17/h8-9H,2-7,10-13H2,1H3/q+1