butane-1-sulfonate; 2-(3-cyclohexyl-1,4-oxathian-4-ium-4-yl)ethanal

Systemtic Name: butane-1-sulfonate; 2-(3-cyclohexyl-1,4-oxathian-4-ium-4-yl)ethanal Openeye Name: butane-1-sulfonate; 2-(3-cyclohexyl-1,4-oxathian-4-ium-4-yl)acetaldehyde CAS Name: 1-butanesulfonate; 2-(3-cyclohexyl-1,4-oxathian-4-ium-4-yl)acetaldehyde IUPAC Name: butane-1-sulfonate; 2-(3-cyclohexyl-1,4-oxathian-4-ium-4-yl)acetaldehyde Traditional Name: butane-1-sulfonate; 2-(3-cyclohexyl-1,4-oxathian-4-ium-4-yl)acetaldehyde Formula: C16H30O5S2 MolecularWeight: 366.5364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)[O-].C1CCC(CC1)C2COCC[S+]2CC=O

Isomeric SMILES

CCCCS(=O)(=O)[O-].C1CCC(CC1)C2COCC[S+]2CC=O

InChI

InChI=1S/C12H21O2S.C4H10O3S/c13-6-8-15-9-7-14-10-12(15)11-4-2-1-3-5-11;1-2-3-4-8(5,6)7/h6,11-12H,1-5,7-10H2;2-4H2,1H3,(H,5,6,7)/q+1;/p-1