(4-benzo[b][1,4]benzoxazepin-6-ylpiperazin-1-yl)-(2-chloranylpyridin-3-yl)methanone

Systemtic Name: (4-benzo[b][1,4]benzoxazepin-6-ylpiperazin-1-yl)-(2-chloranylpyridin-3-yl)methanone Openeye Name: (4-benzo[b][1,4]benzoxazepin-6-ylpiperazin-1-yl)-(2-chloro-3-pyridyl)methanone CAS Name: [4-(6-benzo[b][1,4]benzoxazepinyl)-1-piperazinyl]-(2-chloro-3-pyridinyl)methanone IUPAC Name: (4-benzo[b][1,4]benzoxazepin-6-ylpiperazin-1-yl)-(2-chloropyridin-3-yl)methanone Traditional Name: (4-benzo[b][1,4]benzoxazepin-6-ylpiperazino)-(2-chloro-3-pyridyl)methanone Formula: C23H19ClN4O2 MolecularWeight: 418.87556

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=CC=CC=C3OC4=CC=CC=C42)C(=O)C5=C(N=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1C2=NC3=CC=CC=C3OC4=CC=CC=C42)C(=O)C5=C(N=CC=C5)Cl

InChI

InChI=1S/C23H19ClN4O2/c24-21-17(7-5-11-25-21)23(29)28-14-12-27(13-15-28)22-16-6-1-3-9-19(16)30-20-10-4-2-8-18(20)26-22/h1-11H,12-15H2