phenacyl benzenesulfonate

Systemtic Name: phenacyl benzenesulfonate Openeye Name: phenacyl benzenesulfonate CAS Name: benzenesulfonic acid phenacyl ester IUPAC Name: phenacyl benzenesulfonate Traditional Name: benzenesulfonic acid phenacyl ester Formula: C14H12O4S MolecularWeight: 276.30768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H12O4S/c15-14(12-7-3-1-4-8-12)11-18-19(16,17)13-9-5-2-6-10-13/h1-10H,11H2