4-chloranyl-N-[4-[2-(4-fluorophenyl)ethyl]-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzamide

Systemtic Name: 4-chloranyl-N-[4-[2-(4-fluorophenyl)ethyl]-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzamide Openeye Name: 4-chloro-N-[4-[2-(4-fluorophenyl)ethyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide CAS Name: 4-chloro-N-[4-[2-(4-fluorophenyl)ethyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide IUPAC Name: 4-chloro-N-[4-[2-(4-fluorophenyl)ethyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide Traditional Name: 4-chloro-N-[4-[2-(4-fluorophenyl)ethyl]-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl]benzamide Formula: C25H22ClFN2O3 MolecularWeight: 452.905183

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)Cl)CCC4=CC=C(C=C4)F

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)Cl)CCC4=CC=C(C=C4)F

InChI

InChI=1S/C25H22ClFN2O3/c1-16-25(31)29(13-12-17-2-8-21(27)9-3-17)15-19-14-22(10-11-23(19)32-16)28-24(30)18-4-6-20(26)7-5-18/h2-11,14,16H,12-13,15H2,1H3,(H,28,30)