pentyl 2-methoxybenzenesulfonate

Systemtic Name: pentyl 2-methoxybenzenesulfonate Openeye Name: pentyl 2-methoxybenzenesulfonate CAS Name: 2-methoxybenzenesulfonic acid pentyl ester IUPAC Name: pentyl 2-methoxybenzenesulfonate Traditional Name: 2-methoxybenzenesulfonic acid amyl ester Formula: C12H18O4S MolecularWeight: 258.33392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOS(=O)(=O)C1=CC=CC=C1OC

Isomeric SMILES

CCCCCOS(=O)(=O)C1=CC=CC=C1OC

InChI

InChI=1S/C12H18O4S/c1-3-4-7-10-16-17(13,14)12-9-6-5-8-11(12)15-2/h5-6,8-9H,3-4,7,10H2,1-2H3