phenacyl 4-methylbenzenesulfonate

Systemtic Name: phenacyl 4-methylbenzenesulfonate Openeye Name: phenacyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid phenacyl ester IUPAC Name: phenacyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid phenacyl ester Formula: C15H14O4S MolecularWeight: 290.33426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14O4S/c1-12-7-9-14(10-8-12)20(17,18)19-11-15(16)13-5-3-2-4-6-13/h2-10H,11H2,1H3