(3R,4S)-4-(4-methoxyphenyl)-3-oxidanyl-1-prop-2-enyl-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one

Systemtic Name: (3R,4S)-4-(4-methoxyphenyl)-3-oxidanyl-1-prop-2-enyl-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one Openeye Name: (3R,4S)-1-allyl-3-hydroxy-4-(4-methoxyphenyl)-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one CAS Name: (3R,4S)-3-hydroxy-4-(4-methoxyphenyl)-1-prop-2-enyl-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one IUPAC Name: (3R,4S)-3-hydroxy-4-(4-methoxyphenyl)-1-prop-2-enyl-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one Traditional Name: (3R,4S)-1-allyl-3-hydroxy-4-(4-methoxyphenyl)-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one Formula: C21H20F3NO3 MolecularWeight: 391.38361

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC3=C(C=CC=C3N(C(=O)C2O)CC=C)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2CC3=C(C=CC=C3N(C(=O)[C@@H]2O)CC=C)C(F)(F)F

InChI

InChI=1S/C21H20F3NO3/c1-3-11-25-18-6-4-5-17(21(22,23)24)16(18)12-15(19(26)20(25)27)13-7-9-14(28-2)10-8-13/h3-10,15,19,26H,1,11-12H2,2H3/t15-,19+/m0/s1