phenyl 3-ethoxypropane-1-sulfonate

Systemtic Name: phenyl 3-ethoxypropane-1-sulfonate Openeye Name: phenyl 3-ethoxypropane-1-sulfonate CAS Name: 3-ethoxy-1-propanesulfonic acid IUPAC Name: phenyl 3-ethoxypropane-1-sulfonate Traditional Name: 3-ethoxypropane-1-sulfonic acid phenyl ester Formula: C11H16O4S MolecularWeight: 244.30734

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCS(=O)(=O)OC1=CC=CC=C1

Isomeric SMILES

CCOCCCS(=O)(=O)OC1=CC=CC=C1

InChI

InChI=1S/C11H16O4S/c1-2-14-9-6-10-16(12,13)15-11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3