1-butoxyethyl 2-methylbenzenesulfonate

Systemtic Name: 1-butoxyethyl 2-methylbenzenesulfonate Openeye Name: 1-butoxyethyl 2-methylbenzenesulfonate CAS Name: 2-methylbenzenesulfonic acid 1-butoxyethyl ester IUPAC Name: 1-butoxyethyl 2-methylbenzenesulfonate Traditional Name: 2-methylbenzenesulfonic acid 1-butoxyethyl ester Formula: C13H20O4S MolecularWeight: 272.3605

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C)OS(=O)(=O)C1=CC=CC=C1C

Isomeric SMILES

CCCCOC(C)OS(=O)(=O)C1=CC=CC=C1C

InChI

InChI=1S/C13H20O4S/c1-4-5-10-16-12(3)17-18(14,15)13-9-7-6-8-11(13)2/h6-9,12H,4-5,10H2,1-3H3