3-chloranyl-N'-pyridin-4-ylcarbonyl-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide

Systemtic Name: 3-chloranyl-N'-pyridin-4-ylcarbonyl-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide Openeye Name: 3-chloro-N'-(pyridine-4-carbonyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide CAS Name: 3-chloro-N'-[oxo(pyridin-4-yl)methyl]-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide IUPAC Name: 3-chloro-N'-(pyridine-4-carbonyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide Traditional Name: 3-chloro-N'-isonicotinoyl-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide Formula: C20H15ClN4O3 MolecularWeight: 394.8111

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15ClN4O3/c21-15-5-6-18-16(11-15)25(12-14-3-1-2-4-17(14)28-18)20(27)24-23-19(26)13-7-9-22-10-8-13/h1-11H,12H2,(H,23,26)(H,24,27)