2-chloranylbutyl 4-methylbenzenesulfonate

Systemtic Name: 2-chloranylbutyl 4-methylbenzenesulfonate Openeye Name: 2-chlorobutyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-chlorobutyl ester IUPAC Name: 2-chlorobutyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-chlorobutyl ester Formula: C11H15ClO3S MolecularWeight: 262.753

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COS(=O)(=O)C1=CC=C(C=C1)C)Cl

Isomeric SMILES

CCC(COS(=O)(=O)C1=CC=C(C=C1)C)Cl

InChI

InChI=1S/C11H15ClO3S/c1-3-10(12)8-15-16(13,14)11-6-4-9(2)5-7-11/h4-7,10H,3,8H2,1-2H3