[3-(3-methylphenoxy)-3-oxidanyl-propyl] 2-chloranylbenzenesulfonate

Systemtic Name: [3-(3-methylphenoxy)-3-oxidanyl-propyl] 2-chloranylbenzenesulfonate Openeye Name: [3-hydroxy-3-(3-methylphenoxy)propyl] 2-chlorobenzenesulfonate CAS Name: 2-chlorobenzenesulfonic acid [3-hydroxy-3-(3-methylphenoxy)propyl] ester IUPAC Name: [3-hydroxy-3-(3-methylphenoxy)propyl] 2-chlorobenzenesulfonate Traditional Name: 2-chlorobenzenesulfonic acid [3-hydroxy-3-(3-methylphenoxy)propyl] ester Formula: C16H17ClO5S MolecularWeight: 356.82118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(CCOS(=O)(=O)C2=CC=CC=C2Cl)O

Isomeric SMILES

CC1=CC(=CC=C1)OC(CCOS(=O)(=O)C2=CC=CC=C2Cl)O

InChI

InChI=1S/C16H17ClO5S/c1-12-5-4-6-13(11-12)22-16(18)9-10-21-23(19,20)15-8-3-2-7-14(15)17/h2-8,11,16,18H,9-10H2,1H3