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

Systemtic Name: [3-(3-methylphenoxy)-3-oxidanyl-propyl] 2-methoxybenzenesulfonate Openeye Name: [3-hydroxy-3-(3-methylphenoxy)propyl] 2-methoxybenzenesulfonate CAS Name: 2-methoxybenzenesulfonic acid [3-hydroxy-3-(3-methylphenoxy)propyl] ester IUPAC Name: [3-hydroxy-3-(3-methylphenoxy)propyl] 2-methoxybenzenesulfonate Traditional Name: 2-methoxybenzenesulfonic acid [3-hydroxy-3-(3-methylphenoxy)propyl] ester Formula: C17H20O6S MolecularWeight: 352.4021

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(CCOS(=O)(=O)C2=CC=CC=C2OC)O

Isomeric SMILES

CC1=CC(=CC=C1)OC(CCOS(=O)(=O)C2=CC=CC=C2OC)O

InChI

InChI=1S/C17H20O6S/c1-13-6-5-7-14(12-13)23-17(18)10-11-22-24(19,20)16-9-4-3-8-15(16)21-2/h3-9,12,17-18H,10-11H2,1-2H3