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

Systemtic Name: N-[5-(6H-benzo[b][1,4]benzoxazepin-5-ylcarbonyl)pyridin-2-yl]-2-methyl-benzamide Openeye Name: N-[5-(6H-benzo[b][1,4]benzoxazepine-5-carbonyl)-2-pyridyl]-2-methyl-benzamide CAS Name: N-[5-[6H-benzo[b][1,4]benzoxazepin-5-yl(oxo)methyl]-2-pyridinyl]-2-methylbenzamide IUPAC Name: N-[5-(6H-benzo[b][1,4]benzoxazepine-5-carbonyl)pyridin-2-yl]-2-methylbenzamide Traditional Name: N-[5-(6H-benzo[b][1,4]benzoxazepine-5-carbonyl)-2-pyridyl]-2-methyl-benzamide Formula: C27H21N3O3 MolecularWeight: 435.47394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=NC=C(C=C2)C(=O)N3CC4=CC=CC=C4OC5=CC=CC=C53

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=NC=C(C=C2)C(=O)N3CC4=CC=CC=C4OC5=CC=CC=C53

InChI

InChI=1S/C27H21N3O3/c1-18-8-2-4-10-21(18)26(31)29-25-15-14-19(16-28-25)27(32)30-17-20-9-3-6-12-23(20)33-24-13-7-5-11-22(24)30/h2-16H,17H2,1H3,(H,28,29,31)