sodium 2-[3,4-bis(oxidanyl)cyclohexyl]ethanesulfonate

Systemtic Name: sodium 2-[3,4-bis(oxidanyl)cyclohexyl]ethanesulfonate Openeye Name: sodium 2-(3,4-dihydroxycyclohexyl)ethanesulfonate CAS Name: sodium 2-(3,4-dihydroxycyclohexyl)ethanesulfonate IUPAC Name: sodium 2-(3,4-dihydroxycyclohexyl)ethanesulfonate Traditional Name: sodium 2-(3,4-dihydroxycyclohexyl)ethanesulfonate Formula: C8H15NaO5S MolecularWeight: 246.25647

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CC1CCS(=O)(=O)[O-])O)O.[Na+]

Isomeric SMILES

C1CC(C(CC1CCS(=O)(=O)[O-])O)O.[Na+]

InChI

InChI=1S/C8H16O5S.Na/c9-7-2-1-6(5-8(7)10)3-4-14(11,12)13;/h6-10H,1-5H2,(H,11,12,13);/q;+1/p-1