3-(4-fluorophenyl)-3-methyl-4-(3-methylphenyl)-1,4-dihydroisoquinolin-2-ium 2-oxide

Systemtic Name: 3-(4-fluorophenyl)-3-methyl-4-(3-methylphenyl)-1,4-dihydroisoquinolin-2-ium 2-oxide Openeye Name: 3-(4-fluorophenyl)-3-methyl-4-(m-tolyl)-1,4-dihydroisoquinolin-2-ium 2-oxide CAS Name: 3-(4-fluorophenyl)-3-methyl-4-(3-methylphenyl)-1,4-dihydroisoquinolin-2-ium 2-oxide IUPAC Name: 3-(4-fluorophenyl)-3-methyl-4-(3-methylphenyl)-1,4-dihydroisoquinolin-2-ium 2-oxide Traditional Name: 3-(4-fluorophenyl)-3-methyl-4-(m-tolyl)-1,4-dihydroisoquinolin-2-ium 2-oxide Formula: C23H21FNO+ MolecularWeight: 346.417343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2C3=CC=CC=C3C[N+](=O)C2(C)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=CC(=C1)C2C3=CC=CC=C3C[N+](=O)C2(C)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H21FNO/c1-16-6-5-8-17(14-16)22-21-9-4-3-7-18(21)15-25(26)23(22,2)19-10-12-20(24)13-11-19/h3-14,22H,15H2,1-2H3/q+1