2-oxidanylidenepentyl 4-methylbenzenesulfonate

Systemtic Name: 2-oxidanylidenepentyl 4-methylbenzenesulfonate Openeye Name: 2-oxopentyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-oxopentyl ester IUPAC Name: 2-oxopentyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-ketopentyl ester Formula: C12H16O4S MolecularWeight: 256.31804

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)COS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCC(=O)COS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C12H16O4S/c1-3-4-11(13)9-16-17(14,15)12-7-5-10(2)6-8-12/h5-8H,3-4,9H2,1-2H3