[2-[2-(4-fluorophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 3-(4-methylphenyl)sulfonylpropanoate

Systemtic Name: [2-[2-(4-fluorophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 3-(4-methylphenyl)sulfonylpropanoate Openeye Name: [2-[2-(4-fluorobenzoyl)hydrazino]-2-oxo-ethyl] 3-(p-tolylsulfonyl)propanoate CAS Name: 3-(4-methylphenyl)sulfonylpropanoic acid [2-[[(4-fluorophenyl)-oxomethyl]hydrazo]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-fluorobenzoyl)hydrazinyl]-2-oxoethyl] 3-(4-methylphenyl)sulfonylpropanoate Traditional Name: 3-tosylpropionic acid [2-[N'-(4-fluorobenzoyl)hydrazino]-2-keto-ethyl] ester Formula: C19H19FN2O6S MolecularWeight: 422.427363

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19FN2O6S/c1-13-2-8-16(9-3-13)29(26,27)11-10-18(24)28-12-17(23)21-22-19(25)14-4-6-15(20)7-5-14/h2-9H,10-12H2,1H3,(H,21,23)(H,22,25)