4-chloranyl-N'-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanoyl]benzohydrazide

Systemtic Name: 4-chloranyl-N'-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanoyl]benzohydrazide Openeye Name: 4-chloro-N'-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetyl]benzohydrazide CAS Name: 4-chloro-N'-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-oxoethyl]benzohydrazide IUPAC Name: 4-chloro-N'-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetyl]benzohydrazide Traditional Name: 4-chloro-N'-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)acetyl]benzohydrazide Formula: C18H17ClN2O4S MolecularWeight: 392.85658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClN2O4S/c19-13-4-2-12(3-5-13)18(23)21-20-17(22)11-26-14-6-7-15-16(10-14)25-9-1-8-24-15/h2-7,10H,1,8-9,11H2,(H,20,22)(H,21,23)