[2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 3-(methylsulfonylmethyl)benzoate

Systemtic Name: [2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 3-(methylsulfonylmethyl)benzoate Openeye Name: [2-(2-benzoylhydrazino)-2-oxo-ethyl] 3-(methylsulfonylmethyl)benzoate CAS Name: 3-(methylsulfonylmethyl)benzoic acid [2-(benzoylhydrazo)-2-oxoethyl] ester IUPAC Name: [2-(2-benzoylhydrazinyl)-2-oxoethyl] 3-(methylsulfonylmethyl)benzoate Traditional Name: 3-(mesylmethyl)benzoic acid [2-(N'-benzoylhydrazino)-2-keto-ethyl] ester Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O6S/c1-27(24,25)12-13-6-5-9-15(10-13)18(23)26-11-16(21)19-20-17(22)14-7-3-2-4-8-14/h2-10H,11-12H2,1H3,(H,19,21)(H,20,22)