1-(4-chlorophenyl)butyl 4-methylbenzenesulfonate

Systemtic Name: 1-(4-chlorophenyl)butyl 4-methylbenzenesulfonate Openeye Name: 1-(4-chlorophenyl)butyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 1-(4-chlorophenyl)butyl ester IUPAC Name: 1-(4-chlorophenyl)butyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 1-(4-chlorophenyl)butyl ester Formula: C17H19ClO3S MolecularWeight: 338.84896

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=C(C=C1)Cl)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCC(C1=CC=C(C=C1)Cl)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C17H19ClO3S/c1-3-4-17(14-7-9-15(18)10-8-14)21-22(19,20)16-11-5-13(2)6-12-16/h5-12,17H,3-4H2,1-2H3