N-[4-oxidanylidene-4-(2-pyridin-2-ylcarbonylhydrazinyl)butyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[4-oxidanylidene-4-(2-pyridin-2-ylcarbonylhydrazinyl)butyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[4-oxo-4-[2-(pyridine-2-carbonyl)hydrazino]butyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[4-oxo-4-[[oxo(2-pyridinyl)methyl]hydrazo]butyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[4-oxo-4-[2-(pyridine-2-carbonyl)hydrazinyl]butyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[4-keto-4-(N'-picolinoylhydrazino)butyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C19H22N4O6S MolecularWeight: 434.46618

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCCC(=O)NNC(=O)C3=CC=CC=N3)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCCC(=O)NNC(=O)C3=CC=CC=N3)OC1

InChI

InChI=1S/C19H22N4O6S/c24-18(22-23-19(25)15-5-1-2-9-20-15)6-3-10-21-30(26,27)14-7-8-16-17(13-14)29-12-4-11-28-16/h1-2,5,7-9,13,21H,3-4,6,10-12H2,(H,22,24)(H,23,25)