3,7-dimethyl-1,7-bis(oxidanyl)octane-1-sulfonate

Systemtic Name: 3,7-dimethyl-1,7-bis(oxidanyl)octane-1-sulfonate Openeye Name: 1,7-dihydroxy-3,7-dimethyl-octane-1-sulfonate CAS Name: 1,7-dihydroxy-3,7-dimethyl-1-octanesulfonate IUPAC Name: 1,7-dihydroxy-3,7-dimethyloctane-1-sulfonate Traditional Name: 1,7-dihydroxy-3,7-dimethyl-octane-1-sulfonate Formula: C10H21O5S- MolecularWeight: 253.33574

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C)O)CC(O)S(=O)(=O)[O-]

Isomeric SMILES

CC(CCCC(C)(C)O)CC(O)S(=O)(=O)[O-]

InChI

InChI=1S/C10H22O5S/c1-8(5-4-6-10(2,3)12)7-9(11)16(13,14)15/h8-9,11-12H,4-7H2,1-3H3,(H,13,14,15)/p-1