1-oxidanylidenebutan-2-yl 2-methylbenzenesulfonate

Systemtic Name: 1-oxidanylidenebutan-2-yl 2-methylbenzenesulfonate Openeye Name: 1-formylpropyl 2-methylbenzenesulfonate CAS Name: 2-methylbenzenesulfonic acid 1-oxobutan-2-yl ester IUPAC Name: 1-oxobutan-2-yl 2-methylbenzenesulfonate Traditional Name: 2-methylbenzenesulfonic acid 1-formylpropyl ester Formula: C11H14O4S MolecularWeight: 242.29146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14O4S/c1-3-10(8-12)15-16(13,14)11-7-5-4-6-9(11)2/h4-8,10H,3H2,1-2H3