7-[(S)-(2-fluorophenyl)-[(6-methylpyridin-1-ium-2-yl)amino]methyl]quinolin-8-ol

Systemtic Name: 7-[(S)-(2-fluorophenyl)-[(6-methylpyridin-1-ium-2-yl)amino]methyl]quinolin-8-ol Openeye Name: 7-[(S)-(2-fluorophenyl)-[(6-methylpyridin-1-ium-2-yl)amino]methyl]quinolin-8-ol CAS Name: 7-[(S)-(2-fluorophenyl)-[(6-methyl-2-pyridin-1-iumyl)amino]methyl]-8-quinolinol IUPAC Name: 7-[(S)-(2-fluorophenyl)-[(6-methylpyridin-1-ium-2-yl)amino]methyl]quinolin-8-ol Traditional Name: 7-[(S)-(2-fluorophenyl)-[(6-methylpyridin-1-ium-2-yl)amino]methyl]quinolin-8-ol Formula: C22H19FN3O+ MolecularWeight: 360.404163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C(=CC=C1)NC(C2=C(C3=C(C=CC=N3)C=C2)O)C4=CC=CC=C4F

Isomeric SMILES

CC1=[NH+]C(=CC=C1)N[C@@H](C2=C(C3=C(C=CC=N3)C=C2)O)C4=CC=CC=C4F

InChI

InChI=1S/C22H18FN3O/c1-14-6-4-10-19(25-14)26-21(16-8-2-3-9-18(16)23)17-12-11-15-7-5-13-24-20(15)22(17)27/h2-13,21,27H,1H3,(H,25,26)/p+1/t21-/m1/s1