1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-3-prop-2-ynyl-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one

Systemtic Name: 1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-3-prop-2-ynyl-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one Openeye Name: 1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-3-prop-2-ynyl-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one CAS Name: 1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-3-prop-2-ynyl-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one IUPAC Name: 1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-3-prop-2-ynyl-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one Traditional Name: 1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-3-propargyl-6-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one Formula: C25H27F3N2O2 MolecularWeight: 444.48929

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C2=CC=CC(=C2CC(C(C1=O)CC#C)C3=CC=C(C=C3)OC)C(F)(F)F

Isomeric SMILES

CN(C)CCN1C2=CC=CC(=C2CC(C(C1=O)CC#C)C3=CC=C(C=C3)OC)C(F)(F)F

InChI

InChI=1S/C25H27F3N2O2/c1-5-7-19-20(17-10-12-18(32-4)13-11-17)16-21-22(25(26,27)28)8-6-9-23(21)30(24(19)31)15-14-29(2)3/h1,6,8-13,19-20H,7,14-16H2,2-4H3