4-(4-methoxyphenyl)-3-prop-2-enyl-6-(trifluoromethyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: 4-(4-methoxyphenyl)-3-prop-2-enyl-6-(trifluoromethyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 3-allyl-4-(4-methoxyphenyl)-6-(trifluoromethyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 4-(4-methoxyphenyl)-3-prop-2-enyl-6-(trifluoromethyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 4-(4-methoxyphenyl)-3-prop-2-enyl-6-(trifluoromethyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 3-allyl-4-(4-methoxyphenyl)-6-(trifluoromethyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C21H20F3NO2 MolecularWeight: 375.38421

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC3=C(C=CC=C3NC(=O)C2CC=C)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)C2CC3=C(C=CC=C3NC(=O)C2CC=C)C(F)(F)F

InChI

InChI=1S/C21H20F3NO2/c1-3-5-15-16(13-8-10-14(27-2)11-9-13)12-17-18(21(22,23)24)6-4-7-19(17)25-20(15)26/h3-4,6-11,15-16H,1,5,12H2,2H3,(H,25,26)