2-(3,4-dimethylphenyl)ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-(3,4-dimethylphenyl)ethyl 4-methylbenzenesulfonate Openeye Name: 2-(3,4-dimethylphenyl)ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-(3,4-dimethylphenyl)ethyl ester IUPAC Name: 2-(3,4-dimethylphenyl)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-(3,4-dimethylphenyl)ethyl ester Formula: C17H20O3S MolecularWeight: 304.4039

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20O3S/c1-13-4-8-17(9-5-13)21(18,19)20-11-10-16-7-6-14(2)15(3)12-16/h4-9,12H,10-11H2,1-3H3