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

Systemtic Name: N-(3,3-dimethyl-4-oxidanylidene-5-prop-2-enyl-2H-1,5-benzoxazepin-8-yl)-3,5-bis(trifluoromethyl)benzamide Openeye Name: N-(5-allyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-3,5-bis(trifluoromethyl)benzamide CAS Name: N-(3,3-dimethyl-4-oxo-5-prop-2-enyl-2H-1,5-benzoxazepin-8-yl)-3,5-bis(trifluoromethyl)benzamide IUPAC Name: N-(3,3-dimethyl-4-oxo-5-prop-2-enyl-2H-1,5-benzoxazepin-8-yl)-3,5-bis(trifluoromethyl)benzamide Traditional Name: N-(5-allyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)-3,5-bis(trifluoromethyl)benzamide Formula: C23H20F6N2O3 MolecularWeight: 486.406919

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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)CC=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)CC=C)C

InChI

InChI=1S/C23H20F6N2O3/c1-4-7-31-17-6-5-16(11-18(17)34-12-21(2,3)20(31)33)30-19(32)13-8-14(22(24,25)26)10-15(9-13)23(27,28)29/h4-6,8-11H,1,7,12H2,2-3H3,(H,30,32)