N-[4-[2-(3,4-dimethoxyphenyl)carbonylhydrazinyl]-4-oxidanylidene-butyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[4-[2-(3,4-dimethoxyphenyl)carbonylhydrazinyl]-4-oxidanylidene-butyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[4-[2-(3,4-dimethoxybenzoyl)hydrazino]-4-oxo-butyl]-4-fluoro-benzenesulfonamide CAS Name: N-[4-[[(3,4-dimethoxyphenyl)-oxomethyl]hydrazo]-4-oxobutyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[4-[2-(3,4-dimethoxybenzoyl)hydrazinyl]-4-oxobutyl]-4-fluorobenzenesulfonamide Traditional Name: 4-fluoro-N-[4-keto-4-(N'-veratroylhydrazino)butyl]benzenesulfonamide Formula: C19H22FN3O6S MolecularWeight: 439.457883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=O)CCCNS(=O)(=O)C2=CC=C(C=C2)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=O)CCCNS(=O)(=O)C2=CC=C(C=C2)F)OC

InChI

InChI=1S/C19H22FN3O6S/c1-28-16-10-5-13(12-17(16)29-2)19(25)23-22-18(24)4-3-11-21-30(26,27)15-8-6-14(20)7-9-15/h5-10,12,21H,3-4,11H2,1-2H3,(H,22,24)(H,23,25)