3-oxidanylbutyl phenylmethanesulfonate

Systemtic Name: 3-oxidanylbutyl phenylmethanesulfonate Openeye Name: 3-hydroxybutyl phenylmethanesulfonate CAS Name: phenylmethanesulfonic acid 3-hydroxybutyl ester IUPAC Name: 3-hydroxybutyl phenylmethanesulfonate Traditional Name: phenylmethanesulfonic acid 3-hydroxybutyl ester Formula: C11H16O4S MolecularWeight: 244.30734

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOS(=O)(=O)CC1=CC=CC=C1)O

Isomeric SMILES

CC(CCOS(=O)(=O)CC1=CC=CC=C1)O

InChI

InChI=1S/C11H16O4S/c1-10(12)7-8-15-16(13,14)9-11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3