butane-1-sulfonate; cyclohexyl-methyl-(2-oxidanylideneheptyl)sulfanium

Systemtic Name: butane-1-sulfonate; cyclohexyl-methyl-(2-oxidanylideneheptyl)sulfanium Openeye Name: butane-1-sulfonate; cyclohexyl-methyl-(2-oxoheptyl)sulfonium CAS Name: 1-butanesulfonate; cyclohexyl-methyl-(2-oxoheptyl)sulfonium IUPAC Name: butane-1-sulfonate; cyclohexyl-methyl-(2-oxoheptyl)sulfanium Traditional Name: butane-1-sulfonate; cyclohexyl-(2-ketoheptyl)-methyl-sulfonium Formula: C18H36O4S2 MolecularWeight: 380.60604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C[S+](C)C1CCCCC1.CCCCS(=O)(=O)[O-]

Isomeric SMILES

CCCCCC(=O)C[S+](C)C1CCCCC1.CCCCS(=O)(=O)[O-]

InChI

InChI=1S/C14H27OS.C4H10O3S/c1-3-4-6-9-13(15)12-16(2)14-10-7-5-8-11-14;1-2-3-4-8(5,6)7/h14H,3-12H2,1-2H3;2-4H2,1H3,(H,5,6,7)/q+1;/p-1