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

Systemtic Name: N-[2-methyl-4-(2-methylpropyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-3-(trifluoromethyl)benzamide Openeye Name: N-(4-isobutyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-(trifluoromethyl)benzamide CAS Name: N-[2-methyl-4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-methyl-4-(2-methylpropyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-(trifluoromethyl)benzamide Traditional Name: N-(4-isobutyl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)-3-(trifluoromethyl)benzamide Formula: C22H23F3N2O3 MolecularWeight: 420.42483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23F3N2O3/c1-13(2)11-27-12-16-10-18(7-8-19(16)30-14(3)21(27)29)26-20(28)15-5-4-6-17(9-15)22(23,24)25/h4-10,13-14H,11-12H2,1-3H3,(H,26,28)