3-(3-methylphenoxy)propane-1-sulfonate

Systemtic Name: 3-(3-methylphenoxy)propane-1-sulfonate Openeye Name: 3-(3-methylphenoxy)propane-1-sulfonate CAS Name: 3-(3-methylphenoxy)-1-propanesulfonate IUPAC Name: 3-(3-methylphenoxy)propane-1-sulfonate Traditional Name: 3-(3-methylphenoxy)propane-1-sulfonate Formula: C10H13O4S- MolecularWeight: 229.27282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCS(=O)(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OCCCS(=O)(=O)[O-]

InChI

InChI=1S/C10H14O4S/c1-9-4-2-5-10(8-9)14-6-3-7-15(11,12)13/h2,4-5,8H,3,6-7H2,1H3,(H,11,12,13)/p-1