ethyl 2-(5-chloranylthiophen-2-yl)-2-oxidanyl-propane-1-sulfonate

Systemtic Name: ethyl 2-(5-chloranylthiophen-2-yl)-2-oxidanyl-propane-1-sulfonate Openeye Name: ethyl 2-(5-chloro-2-thienyl)-2-hydroxy-propane-1-sulfonate CAS Name: 2-(5-chloro-2-thiophenyl)-2-hydroxy-1-propanesulfonic acid IUPAC Name: ethyl 2-(5-chlorothiophen-2-yl)-2-hydroxypropane-1-sulfonate Traditional Name: 2-(5-chloro-2-thienyl)-2-hydroxy-propane-1-sulfonic acid ethyl ester Formula: C9H13ClO4S2 MolecularWeight: 284.78012

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Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)(=O)CC(C)(C1=CC=C(S1)Cl)O

Isomeric SMILES

CCOS(=O)(=O)CC(C)(C1=CC=C(S1)Cl)O

InChI

InChI=1S/C9H13ClO4S2/c1-3-14-16(12,13)6-9(2,11)7-4-5-8(10)15-7/h4-5,11H,3,6H2,1-2H3