2-ethoxy-1-ethyl-3-propylsulfinyl-pyridin-1-ium; 2,2,3,3,16-pentamethyl-1-oxacyclohexadecane; chloride

Systemtic Name: 2-ethoxy-1-ethyl-3-propylsulfinyl-pyridin-1-ium; 2,2,3,3,16-pentamethyl-1-oxacyclohexadecane; chloride Openeye Name: 2-ethoxy-1-ethyl-3-propylsulfinyl-pyridin-1-ium; 2,2,3,3,16-pentamethyl-oxacyclohexadecane; chloride CAS Name: 2-ethoxy-1-ethyl-3-propylsulfinylpyridin-1-ium; 2,2,3,3,16-pentamethyl-oxacyclohexadecane; chloride IUPAC Name: 2-ethoxy-1-ethyl-3-propylsulfinylpyridin-1-ium; 2,2,3,3,16-pentamethyl-oxacyclohexadecane; chloride Traditional Name: 2-ethoxy-1-ethyl-3-propylsulfinyl-pyridin-1-ium; 2,2,3,3,16-pentamethyl-oxacyclohexadecane; chloride Formula: C32H60ClNO3S MolecularWeight: 574.3417

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)C1=C([N+](=CC=C1)CC)OCC.CC1CCCCCCCCCCCCC(C(O1)(C)C)(C)C.[Cl-]

Isomeric SMILES

CCCS(=O)C1=C([N+](=CC=C1)CC)OCC.CC1CCCCCCCCCCCCC(C(O1)(C)C)(C)C.[Cl-]

InChI

InChI=1S/C20H40O.C12H20NO2S.ClH/c1-18-16-14-12-10-8-6-7-9-11-13-15-17-19(2,3)20(4,5)21-18;1-4-10-16(14)11-8-7-9-13(5-2)12(11)15-6-3;/h18H,6-17H2,1-5H3;7-9H,4-6,10H2,1-3H3;1H/q;+1;/p-1