2-[(3-chloranyl-6H-benzo[b][1,4]benzoxazepin-5-yl)methyl]-N-pyridin-4-yl-1,3-oxazole-4-carboxamide

Systemtic Name: 2-[(3-chloranyl-6H-benzo[b][1,4]benzoxazepin-5-yl)methyl]-N-pyridin-4-yl-1,3-oxazole-4-carboxamide Openeye Name: 2-[(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)methyl]-N-(4-pyridyl)oxazole-4-carboxamide CAS Name: 2-[(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)methyl]-N-pyridin-4-yl-4-oxazolecarboxamide IUPAC Name: 2-[(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)methyl]-N-pyridin-4-yl-1,3-oxazole-4-carboxamide Traditional Name: 2-[(3-chloro-6H-benzo[b][1,4]benzoxazepin-5-yl)methyl]-N-(4-pyridyl)oxazole-4-carboxamide Formula: C23H17ClN4O3 MolecularWeight: 432.85908

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OC3=C(N1CC4=NC(=CO4)C(=O)NC5=CC=NC=C5)C=C(C=C3)Cl

Isomeric SMILES

C1C2=CC=CC=C2OC3=C(N1CC4=NC(=CO4)C(=O)NC5=CC=NC=C5)C=C(C=C3)Cl

InChI

InChI=1S/C23H17ClN4O3/c24-16-5-6-21-19(11-16)28(12-15-3-1-2-4-20(15)31-21)13-22-27-18(14-30-22)23(29)26-17-7-9-25-10-8-17/h1-11,14H,12-13H2,(H,25,26,29)