1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-3-prop-2-ynyl-7-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one

Systemtic Name: 1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-3-prop-2-ynyl-7-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one Openeye Name: 1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-3-prop-2-ynyl-7-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one CAS Name: 1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-3-prop-2-ynyl-7-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one IUPAC Name: 1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-3-prop-2-ynyl-7-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one Traditional Name: 1-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)-3-propargyl-7-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepin-2-one Formula: C25H27F3N2O2 MolecularWeight: 444.48929

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C2=C(CC(C(C1=O)CC#C)C3=CC=C(C=C3)OC)C=C(C=C2)C(F)(F)F

Isomeric SMILES

CN(C)CCN1C2=C(CC(C(C1=O)CC#C)C3=CC=C(C=C3)OC)C=C(C=C2)C(F)(F)F

InChI

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