2-[4-(4-methoxyphenyl)-3-methyl-2-oxidanylidene-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-1-yl]propanenitrile

Systemtic Name: 2-[4-(4-methoxyphenyl)-3-methyl-2-oxidanylidene-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-1-yl]propanenitrile Openeye Name: 2-[4-(4-methoxyphenyl)-3-methyl-2-oxo-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-1-yl]propanenitrile CAS Name: 2-[4-(4-methoxyphenyl)-3-methyl-2-oxo-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-1-yl]propanenitrile IUPAC Name: 2-[4-(4-methoxyphenyl)-3-methyl-2-oxo-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-1-yl]propanenitrile Traditional Name: 2-[2-keto-4-(4-methoxyphenyl)-3-methyl-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-1-yl]propionitrile Formula: C22H21F3N2O2 MolecularWeight: 402.40955

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC2=C(C=CC=C2N(C1=O)C(C)C#N)C(F)(F)F)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1C(CC2=C(C=CC=C2N(C1=O)C(C)C#N)C(F)(F)F)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H21F3N2O2/c1-13(12-26)27-20-6-4-5-19(22(23,24)25)18(20)11-17(14(2)21(27)28)15-7-9-16(29-3)10-8-15/h4-10,13-14,17H,11H2,1-3H3