N-[5-(6H-benzo[b][1,4]benzoxazepin-5-ylcarbonyl)pyridin-2-yl]-2-pyridin-2-yl-benzamide

Systemtic Name: N-[5-(6H-benzo[b][1,4]benzoxazepin-5-ylcarbonyl)pyridin-2-yl]-2-pyridin-2-yl-benzamide Openeye Name: N-[5-(6H-benzo[b][1,4]benzoxazepine-5-carbonyl)-2-pyridyl]-2-(2-pyridyl)benzamide CAS Name: N-[5-[6H-benzo[b][1,4]benzoxazepin-5-yl(oxo)methyl]-2-pyridinyl]-2-(2-pyridinyl)benzamide IUPAC Name: N-[5-(6H-benzo[b][1,4]benzoxazepine-5-carbonyl)pyridin-2-yl]-2-pyridin-2-ylbenzamide Traditional Name: N-[5-(6H-benzo[b][1,4]benzoxazepine-5-carbonyl)-2-pyridyl]-2-(2-pyridyl)benzamide Formula: C31H22N4O3 MolecularWeight: 498.53138

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2OC3=CC=CC=C3N1C(=O)C4=CN=C(C=C4)NC(=O)C5=CC=CC=C5C6=CC=CC=N6

Isomeric SMILES

C1C2=CC=CC=C2OC3=CC=CC=C3N1C(=O)C4=CN=C(C=C4)NC(=O)C5=CC=CC=C5C6=CC=CC=N6

InChI

InChI=1S/C31H22N4O3/c36-30(24-11-3-2-10-23(24)25-12-7-8-18-32-25)34-29-17-16-21(19-33-29)31(37)35-20-22-9-1-5-14-27(22)38-28-15-6-4-13-26(28)35/h1-19H,20H2,(H,33,34,36)