1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N'-(phenylcarbonyl)piperidine-4-carbohydrazide

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N'-(phenylcarbonyl)piperidine-4-carbohydrazide Openeye Name: N'-benzoyl-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidine-4-carbohydrazide CAS Name: N'-benzoyl-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-piperidinecarbohydrazide IUPAC Name: N'-benzoyl-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidine-4-carbohydrazide Traditional Name: N'-benzoyl-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)isonipecotohydrazide Formula: C22H25N3O6S MolecularWeight: 459.5154

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NNC(=O)C4=CC=CC=C4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NNC(=O)C4=CC=CC=C4)OC1

InChI

InChI=1S/C22H25N3O6S/c26-21(16-5-2-1-3-6-16)23-24-22(27)17-9-11-25(12-10-17)32(28,29)18-7-8-19-20(15-18)31-14-4-13-30-19/h1-3,5-8,15,17H,4,9-14H2,(H,23,26)(H,24,27)