N'-(4-fluoranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonyl-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide

Systemtic Name: N'-(4-fluoranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonyl-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Openeye Name: N'-[4-fluoro-3-(1-piperidylsulfonyl)benzoyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide CAS Name: N'-[[4-fluoro-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide IUPAC Name: N'-(4-fluoro-3-piperidin-1-ylsulfonylbenzoyl)-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Traditional Name: N'-(4-fluoro-3-piperidinosulfonyl-benzoyl)-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide Formula: C21H22FN3O6S MolecularWeight: 463.479283

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NNC(=O)C3COC4=CC=CC=C4O3)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NNC(=O)C3COC4=CC=CC=C4O3)F

InChI

InChI=1S/C21H22FN3O6S/c22-15-9-8-14(12-19(15)32(28,29)25-10-4-1-5-11-25)20(26)23-24-21(27)18-13-30-16-6-2-3-7-17(16)31-18/h2-3,6-9,12,18H,1,4-5,10-11,13H2,(H,23,26)(H,24,27)