N-[6-[2-(3-methylbutanoyl)hydrazinyl]-6-oxidanylidene-hexyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[6-[2-(3-methylbutanoyl)hydrazinyl]-6-oxidanylidene-hexyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[6-[2-(3-methylbutanoyl)hydrazino]-6-oxo-hexyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[6-[(3-methyl-1-oxobutyl)hydrazo]-6-oxohexyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[6-[2-(3-methylbutanoyl)hydrazinyl]-6-oxohexyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[6-(N'-isovalerylhydrazino)-6-keto-hexyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C19H29N3O6S MolecularWeight: 427.51506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NNC(=O)CCCCCNS(=O)(=O)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CC(C)CC(=O)NNC(=O)CCCCCNS(=O)(=O)C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C19H29N3O6S/c1-14(2)12-19(24)22-21-18(23)6-4-3-5-9-20-29(25,26)15-7-8-16-17(13-15)28-11-10-27-16/h7-8,13-14,20H,3-6,9-12H2,1-2H3,(H,21,23)(H,22,24)