[2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 2-methyl-5-methylsulfonyl-benzoate Openeye Name: [2-(2-benzoylhydrazino)-2-oxo-ethyl] 2-methyl-5-methylsulfonyl-benzoate CAS Name: 2-methyl-5-methylsulfonylbenzoic acid [2-(benzoylhydrazo)-2-oxoethyl] ester IUPAC Name: [2-(2-benzoylhydrazinyl)-2-oxoethyl] 2-methyl-5-methylsulfonylbenzoate Traditional Name: 5-mesyl-2-methyl-benzoic acid [2-(N'-benzoylhydrazino)-2-keto-ethyl] ester Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O6S/c1-12-8-9-14(27(2,24)25)10-15(12)18(23)26-11-16(21)19-20-17(22)13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H,19,21)(H,20,22)