3,5-bis(trifluoromethyl)-N-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)benzamide

Systemtic Name: 3,5-bis(trifluoromethyl)-N-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)benzamide Openeye Name: 3,5-bis(trifluoromethyl)-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)benzamide CAS Name: 3,5-bis(trifluoromethyl)-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)benzamide IUPAC Name: 3,5-bis(trifluoromethyl)-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)benzamide Traditional Name: N-(4-keto-3,3,5-trimethyl-2H-1,5-benzoxazepin-8-yl)-3,5-bis(trifluoromethyl)benzamide Formula: C21H18F6N2O3 MolecularWeight: 460.369639

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=CC(=C2)NC(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)N(C1=O)C)C

Isomeric SMILES

CC1(COC2=C(C=CC(=C2)NC(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)N(C1=O)C)C

InChI

InChI=1S/C21H18F6N2O3/c1-19(2)10-32-16-9-14(4-5-15(16)29(3)18(19)31)28-17(30)11-6-12(20(22,23)24)8-13(7-11)21(25,26)27/h4-9H,10H2,1-3H3,(H,28,30)