2-(3,5-dimethylphenoxy)ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl 4-methylbenzenesulfonate Openeye Name: 2-(3,5-dimethylphenoxy)ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-(3,5-dimethylphenoxy)ethyl ester IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-(3,5-dimethylphenoxy)ethyl ester Formula: C17H20O4S MolecularWeight: 320.4033

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC(=CC(=C2)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C17H20O4S/c1-13-4-6-17(7-5-13)22(18,19)21-9-8-20-16-11-14(2)10-15(3)12-16/h4-7,10-12H,8-9H2,1-3H3