3-chloranyl-N'-(2-pyridin-4-ylethanoyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide

Systemtic Name: 3-chloranyl-N'-(2-pyridin-4-ylethanoyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide Openeye Name: 3-chloro-N'-[2-(4-pyridyl)acetyl]-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide CAS Name: 3-chloro-N'-(1-oxo-2-pyridin-4-ylethyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide IUPAC Name: 3-chloro-N'-(2-pyridin-4-ylacetyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide Traditional Name: 3-chloro-N'-[2-(4-pyridyl)acetyl]-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide Formula: C21H17ClN4O3 MolecularWeight: 408.83768

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OC3=C(N1C(=O)NNC(=O)CC4=CC=NC=C4)C=C(C=C3)Cl

Isomeric SMILES

C1C2=CC=CC=C2OC3=C(N1C(=O)NNC(=O)CC4=CC=NC=C4)C=C(C=C3)Cl

InChI

InChI=1S/C21H17ClN4O3/c22-16-5-6-19-17(12-16)26(13-15-3-1-2-4-18(15)29-19)21(28)25-24-20(27)11-14-7-9-23-10-8-14/h1-10,12H,11,13H2,(H,24,27)(H,25,28)