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

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N'-(4-methylphenyl)carbonyl-piperidine-4-carbohydrazide Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N'-(4-methylbenzoyl)piperidine-4-carbohydrazide CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N'-[(4-methylphenyl)-oxomethyl]-4-piperidinecarbohydrazide IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N'-(4-methylbenzoyl)piperidine-4-carbohydrazide Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N'-p-toluoyl-isonipecotohydrazide Formula: C23H27N3O6S MolecularWeight: 473.54198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C23H27N3O6S/c1-16-3-5-17(6-4-16)22(27)24-25-23(28)18-9-11-26(12-10-18)33(29,30)19-7-8-20-21(15-19)32-14-2-13-31-20/h3-8,15,18H,2,9-14H2,1H3,(H,24,27)(H,25,28)