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

Systemtic Name: 1-[3-oxidanylidene-4-[[3-(trifluoromethyl)phenyl]methyl]-5H-1,4-benzoxazepin-7-yl]-3-phenyl-urea Openeye Name: 1-[3-oxo-4-[[3-(trifluoromethyl)phenyl]methyl]-5H-1,4-benzoxazepin-7-yl]-3-phenyl-urea CAS Name: 1-[3-oxo-4-[[3-(trifluoromethyl)phenyl]methyl]-5H-1,4-benzoxazepin-7-yl]-3-phenylurea IUPAC Name: 1-[3-oxo-4-[[3-(trifluoromethyl)phenyl]methyl]-5H-1,4-benzoxazepin-7-yl]-3-phenylurea Traditional Name: 1-[3-keto-4-[3-(trifluoromethyl)benzyl]-5H-1,4-benzoxazepin-7-yl]-3-phenyl-urea Formula: C24H20F3N3O3 MolecularWeight: 455.42911

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)NC(=O)NC3=CC=CC=C3)OCC(=O)N1CC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1C2=C(C=CC(=C2)NC(=O)NC3=CC=CC=C3)OCC(=O)N1CC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C24H20F3N3O3/c25-24(26,27)18-6-4-5-16(11-18)13-30-14-17-12-20(9-10-21(17)33-15-22(30)31)29-23(32)28-19-7-2-1-3-8-19/h1-12H,13-15H2,(H2,28,29,32)