phenacyl 4-methylsulfonylbenzoate

Systemtic Name: phenacyl 4-methylsulfonylbenzoate Openeye Name: phenacyl 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid phenacyl ester IUPAC Name: phenacyl 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid phenacyl ester Formula: C16H14O5S MolecularWeight: 318.34436

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H14O5S/c1-22(19,20)14-9-7-13(8-10-14)16(18)21-11-15(17)12-5-3-2-4-6-12/h2-10H,11H2,1H3