3-chloranyl-1-hexoxy-1-oxidanylidene-propane-2-sulfonic acid

Systemtic Name: 3-chloranyl-1-hexoxy-1-oxidanylidene-propane-2-sulfonic acid Openeye Name: 3-chloro-1-hexoxy-1-oxo-propane-2-sulfonic acid CAS Name: 3-chloro-1-hexoxy-1-oxo-2-propanesulfonic acid IUPAC Name: 3-chloro-1-hexoxy-1-oxopropane-2-sulfonic acid Traditional Name: 3-chloro-1-hexoxy-1-keto-propane-2-sulfonic acid Formula: C9H17ClO5S MolecularWeight: 272.74628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(CCl)S(=O)(=O)O

Isomeric SMILES

CCCCCCOC(=O)C(CCl)S(=O)(=O)O

InChI

InChI=1S/C9H17ClO5S/c1-2-3-4-5-6-15-9(11)8(7-10)16(12,13)14/h8H,2-7H2,1H3,(H,12,13,14)