N'-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)carbonyl]quinoline-2-carbohydrazide

Systemtic Name: N'-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)carbonyl]quinoline-2-carbohydrazide Openeye Name: N'-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carbonyl)quinoline-2-carbohydrazide CAS Name: N'-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-oxomethyl]-2-quinolinecarbohydrazide IUPAC Name: N'-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carbonyl)quinoline-2-carbohydrazide Traditional Name: N'-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carbonyl)quinaldohydrazide Formula: C20H16ClN3O4 MolecularWeight: 397.81174

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C(=O)NNC(=O)C3=NC4=CC=CC=C4C=C3)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)C(=O)NNC(=O)C3=NC4=CC=CC=C4C=C3)Cl)OC1

InChI

InChI=1S/C20H16ClN3O4/c21-14-10-13(11-17-18(14)28-9-3-8-27-17)19(25)23-24-20(26)16-7-6-12-4-1-2-5-15(12)22-16/h1-2,4-7,10-11H,3,8-9H2,(H,23,25)(H,24,26)