(3-methoxy-5-propyl-phenyl) 2-chloranylbenzenesulfonate

Systemtic Name: (3-methoxy-5-propyl-phenyl) 2-chloranylbenzenesulfonate Openeye Name: (3-methoxy-5-propyl-phenyl) 2-chlorobenzenesulfonate CAS Name: 2-chlorobenzenesulfonic acid (3-methoxy-5-propylphenyl) ester IUPAC Name: (3-methoxy-5-propylphenyl) 2-chlorobenzenesulfonate Traditional Name: 2-chlorobenzenesulfonic acid (3-methoxy-5-propyl-phenyl) ester Formula: C16H17ClO4S MolecularWeight: 340.82178

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC(=C1)OS(=O)(=O)C2=CC=CC=C2Cl)OC

Isomeric SMILES

CCCC1=CC(=CC(=C1)OS(=O)(=O)C2=CC=CC=C2Cl)OC

InChI

InChI=1S/C16H17ClO4S/c1-3-6-12-9-13(20-2)11-14(10-12)21-22(18,19)16-8-5-4-7-15(16)17/h4-5,7-11H,3,6H2,1-2H3