2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)-N-[3-(2-pyridin-2-ylethynyl)phenyl]ethanamide

Systemtic Name: 2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)-N-[3-(2-pyridin-2-ylethynyl)phenyl]ethanamide Openeye Name: 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)-N-[3-[2-(2-pyridyl)ethynyl]phenyl]acetamide CAS Name: 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]acetamide IUPAC Name: 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)-N-[3-(2-pyridin-2-ylethynyl)phenyl]acetamide Traditional Name: 2-(4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl)-N-[3-[2-(2-pyridyl)ethynyl]phenyl]acetamide Formula: C24H19N3O3 MolecularWeight: 397.42596

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2N(C1=O)CC(=O)NC3=CC=CC(=C3)C#CC4=CC=CC=N4

Isomeric SMILES

C1COC2=CC=CC=C2N(C1=O)CC(=O)NC3=CC=CC(=C3)C#CC4=CC=CC=N4

InChI

InChI=1S/C24H19N3O3/c28-23(17-27-21-9-1-2-10-22(21)30-15-13-24(27)29)26-20-8-5-6-18(16-20)11-12-19-7-3-4-14-25-19/h1-10,14,16H,13,15,17H2,(H,26,28)