methyl-[[2-methyl-4-oxidanylidene-7-(trifluoromethyl)-1H-quinolin-3-yl]methyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[[2-methyl-4-oxidanylidene-7-(trifluoromethyl)-1H-quinolin-3-yl]methyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[[2-methyl-4-oxo-7-(trifluoromethyl)-1H-quinolin-3-yl]methyl]ammonium CAS Name: methyl-[[2-methyl-4-oxo-7-(trifluoromethyl)-1H-quinolin-3-yl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[[2-methyl-4-oxo-7-(trifluoromethyl)-1H-quinolin-3-yl]methyl]azanium Traditional Name: benzyl-[[4-keto-2-methyl-7-(trifluoromethyl)-1H-quinolin-3-yl]methyl]-methyl-ammonium Formula: C20H20F3N2O+ MolecularWeight: 361.38081

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(N1)C=C(C=C2)C(F)(F)F)C[NH+](C)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)C2=C(N1)C=C(C=C2)C(F)(F)F)C[NH+](C)CC3=CC=CC=C3

InChI

InChI=1S/C20H19F3N2O/c1-13-17(12-25(2)11-14-6-4-3-5-7-14)19(26)16-9-8-15(20(21,22)23)10-18(16)24-13/h3-10H,11-12H2,1-2H3,(H,24,26)/p+1