3-(2-azanylethyl)-4-(4-methoxyphenyl)-1-methyl-6-(trifluoromethyl)-5H-1-benzazepin-2-one

Systemtic Name: 3-(2-azanylethyl)-4-(4-methoxyphenyl)-1-methyl-6-(trifluoromethyl)-5H-1-benzazepin-2-one Openeye Name: 3-(2-aminoethyl)-4-(4-methoxyphenyl)-1-methyl-6-(trifluoromethyl)-5H-1-benzazepin-2-one CAS Name: 3-(2-aminoethyl)-4-(4-methoxyphenyl)-1-methyl-6-(trifluoromethyl)-5H-1-benzazepin-2-one IUPAC Name: 3-(2-aminoethyl)-4-(4-methoxyphenyl)-1-methyl-6-(trifluoromethyl)-5H-1-benzazepin-2-one Traditional Name: 3-(2-aminoethyl)-4-(4-methoxyphenyl)-1-methyl-6-(trifluoromethyl)-5H-1-benzazepin-2-one Formula: C21H21F3N2O2 MolecularWeight: 390.39885

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC(=C2CC(=C(C1=O)CCN)C3=CC=C(C=C3)OC)C(F)(F)F

Isomeric SMILES

CN1C2=CC=CC(=C2CC(=C(C1=O)CCN)C3=CC=C(C=C3)OC)C(F)(F)F

InChI

InChI=1S/C21H21F3N2O2/c1-26-19-5-3-4-18(21(22,23)24)17(19)12-16(15(10-11-25)20(26)27)13-6-8-14(28-2)9-7-13/h3-9H,10-12,25H2,1-2H3