(4-chloranyl-4-oxidanylidene-butyl) 4-methylbenzenesulfonate

Systemtic Name: (4-chloranyl-4-oxidanylidene-butyl) 4-methylbenzenesulfonate Openeye Name: (4-chloro-4-oxo-butyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (4-chloro-4-oxobutyl) ester IUPAC Name: (4-chloro-4-oxobutyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-chloro-4-keto-butyl) ester Formula: C11H13ClO4S MolecularWeight: 276.73652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC(=O)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCC(=O)Cl

InChI

InChI=1S/C11H13ClO4S/c1-9-4-6-10(7-5-9)17(14,15)16-8-2-3-11(12)13/h4-7H,2-3,8H2,1H3