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

Systemtic Name: N-[2-methyl-4-(3-methylbutyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-3-(trifluoromethyl)benzamide Openeye Name: N-(4-isopentyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-(trifluoromethyl)benzamide CAS Name: N-[2-methyl-4-(3-methylbutyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-methyl-4-(3-methylbutyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-(trifluoromethyl)benzamide Traditional Name: N-(4-isoamyl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)-3-(trifluoromethyl)benzamide Formula: C23H25F3N2O3 MolecularWeight: 434.45141

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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)C(F)(F)F)CCC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C23H25F3N2O3/c1-14(2)9-10-28-13-17-12-19(7-8-20(17)31-15(3)22(28)30)27-21(29)16-5-4-6-18(11-16)23(24,25)26/h4-8,11-12,14-15H,9-10,13H2,1-3H3,(H,27,29)