2-(3-chlorophenyl)ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-(3-chlorophenyl)ethyl 4-methylbenzenesulfonate Openeye Name: 2-(3-chlorophenyl)ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-(3-chlorophenyl)ethyl ester IUPAC Name: 2-(3-chlorophenyl)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-(3-chlorophenyl)ethyl ester Formula: C15H15ClO3S MolecularWeight: 310.7958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC2=CC(=CC=C2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C15H15ClO3S/c1-12-5-7-15(8-6-12)20(17,18)19-10-9-13-3-2-4-14(16)11-13/h2-8,11H,9-10H2,1H3