7-chloranyl-N'-[2-(2-oxidanylideneazepan-1-yl)ethanoyl]-1,3-benzodioxole-5-carbohydrazide

Systemtic Name: 7-chloranyl-N'-[2-(2-oxidanylideneazepan-1-yl)ethanoyl]-1,3-benzodioxole-5-carbohydrazide Openeye Name: 7-chloro-N'-[2-(2-oxoazepan-1-yl)acetyl]-1,3-benzodioxole-5-carbohydrazide CAS Name: 7-chloro-N'-[1-oxo-2-(2-oxo-1-azepanyl)ethyl]-1,3-benzodioxole-5-carbohydrazide IUPAC Name: 7-chloro-N'-[2-(2-oxoazepan-1-yl)acetyl]-1,3-benzodioxole-5-carbohydrazide Traditional Name: 7-chloro-N'-[2-(2-ketoazepan-1-yl)acetyl]-1,3-benzodioxole-5-carbohydrazide Formula: C16H18ClN3O5 MolecularWeight: 367.78422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)NNC(=O)C2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)NNC(=O)C2=CC3=C(C(=C2)Cl)OCO3

InChI

InChI=1S/C16H18ClN3O5/c17-11-6-10(7-12-15(11)25-9-24-12)16(23)19-18-13(21)8-20-5-3-1-2-4-14(20)22/h6-7H,1-5,8-9H2,(H,18,21)(H,19,23)