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

Systemtic Name: 3-chloranyl-N'-(4-pyridin-2-ylbutanoyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide Openeye Name: 3-chloro-N'-[4-(2-pyridyl)butanoyl]-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide CAS Name: 3-chloro-N'-[1-oxo-4-(2-pyridinyl)butyl]-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide IUPAC Name: 3-chloro-N'-(4-pyridin-2-ylbutanoyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide Traditional Name: 3-chloro-N'-[4-(2-pyridyl)butanoyl]-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide Formula: C23H21ClN4O3 MolecularWeight: 436.89084

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OC3=C(N1C(=O)NNC(=O)CCCC4=CC=CC=N4)C=C(C=C3)Cl

Isomeric SMILES

C1C2=CC=CC=C2OC3=C(N1C(=O)NNC(=O)CCCC4=CC=CC=N4)C=C(C=C3)Cl

InChI

InChI=1S/C23H21ClN4O3/c24-17-11-12-21-19(14-17)28(15-16-6-1-2-9-20(16)31-21)23(30)27-26-22(29)10-5-8-18-7-3-4-13-25-18/h1-4,6-7,9,11-14H,5,8,10,15H2,(H,26,29)(H,27,30)