N-[2-methyl-3-oxidanylidene-4-[[3-(trifluoromethyl)phenyl]methyl]-5H-1,4-benzoxazepin-7-yl]benzamide

Systemtic Name: N-[2-methyl-3-oxidanylidene-4-[[3-(trifluoromethyl)phenyl]methyl]-5H-1,4-benzoxazepin-7-yl]benzamide Openeye Name: N-[2-methyl-3-oxo-4-[[3-(trifluoromethyl)phenyl]methyl]-5H-1,4-benzoxazepin-7-yl]benzamide CAS Name: N-[2-methyl-3-oxo-4-[[3-(trifluoromethyl)phenyl]methyl]-5H-1,4-benzoxazepin-7-yl]benzamide IUPAC Name: N-[2-methyl-3-oxo-4-[[3-(trifluoromethyl)phenyl]methyl]-5H-1,4-benzoxazepin-7-yl]benzamide Traditional Name: N-[3-keto-2-methyl-4-[3-(trifluoromethyl)benzyl]-5H-1,4-benzoxazepin-7-yl]benzamide Formula: C25H21F3N2O3 MolecularWeight: 454.44105

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CC=C3)CC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CC=C3)CC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C25H21F3N2O3/c1-16-24(32)30(14-17-6-5-9-20(12-17)25(26,27)28)15-19-13-21(10-11-22(19)33-16)29-23(31)18-7-3-2-4-8-18/h2-13,16H,14-15H2,1H3,(H,29,31)