phenacyl 4-(methylsulfonylmethyl)benzoate

Systemtic Name: phenacyl 4-(methylsulfonylmethyl)benzoate Openeye Name: phenacyl 4-(methylsulfonylmethyl)benzoate CAS Name: 4-(methylsulfonylmethyl)benzoic acid phenacyl ester IUPAC Name: phenacyl 4-(methylsulfonylmethyl)benzoate Traditional Name: 4-(mesylmethyl)benzoic acid phenacyl ester Formula: C17H16O5S MolecularWeight: 332.37094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16O5S/c1-23(20,21)12-13-7-9-15(10-8-13)17(19)22-11-16(18)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3