ethane; phenyl 4-methylbenzenesulfonate

Systemtic Name: ethane; phenyl 4-methylbenzenesulfonate Openeye Name: ethane; phenyl 4-methylbenzenesulfonate CAS Name: ethane; 4-methylbenzenesulfonic acid phenyl ester IUPAC Name: ethane; phenyl 4-methylbenzenesulfonate Traditional Name: ethane; 4-methylbenzenesulfonic acid phenyl ester Formula: C15H18O3S MolecularWeight: 278.36662

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Descriptors Computed from Structure

Canonical SMILES:

CC.CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2

Isomeric SMILES

CC.CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2

InChI

InChI=1S/C13H12O3S.C2H6/c1-11-7-9-13(10-8-11)17(14,15)16-12-5-3-2-4-6-12;1-2/h2-10H,1H3;1-2H3