2-chloranyl-N-(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-4-fluoranyl-benzamide

Systemtic Name: 2-chloranyl-N-(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-4-fluoranyl-benzamide Openeye Name: 2-chloro-N-(3,5-dimethyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)-4-fluoro-benzamide CAS Name: 2-chloro-N-(3,5-dimethyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)-4-fluorobenzamide IUPAC Name: 2-chloro-N-(3,5-dimethyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)-4-fluorobenzamide Traditional Name: 2-chloro-4-fluoro-N-(6-keto-3,5-dimethyl-benzo[b][1,4]benzoxazepin-8-yl)benzamide Formula: C22H16ClFN2O3 MolecularWeight: 410.825443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NC(=O)C4=C(C=C(C=C4)F)Cl)C(=O)N2C

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NC(=O)C4=C(C=C(C=C4)F)Cl)C(=O)N2C

InChI

InChI=1S/C22H16ClFN2O3/c1-12-3-7-20-18(9-12)26(2)22(28)16-11-14(5-8-19(16)29-20)25-21(27)15-6-4-13(24)10-17(15)23/h3-11H,1-2H3,(H,25,27)