7-[[(4-fluorophenyl)amino]-pyridin-1-ium-4-yl-methyl]quinolin-1-ium-8-ol

Systemtic Name: 7-[[(4-fluorophenyl)amino]-pyridin-1-ium-4-yl-methyl]quinolin-1-ium-8-ol Openeye Name: 7-[(4-fluoroanilino)-pyridin-1-ium-4-yl-methyl]quinolin-1-ium-8-ol CAS Name: 7-[(4-fluoroanilino)-(4-pyridin-1-iumyl)methyl]-8-quinolin-1-iumol IUPAC Name: 7-[(4-fluoroanilino)-pyridin-1-ium-4-ylmethyl]quinolin-1-ium-8-ol Traditional Name: 7-[(4-fluoroanilino)-pyridin-1-ium-4-yl-methyl]quinolin-1-ium-8-ol Formula: C21H18FN3O+2 MolecularWeight: 347.385523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C(C=C2)C(C3=CC=[NH+]C=C3)NC4=CC=C(C=C4)F)O)[NH+]=C1

Isomeric SMILES

C1=CC2=C(C(=C(C=C2)C(C3=CC=[NH+]C=C3)NC4=CC=C(C=C4)F)O)[NH+]=C1

InChI

InChI=1S/C21H16FN3O/c22-16-4-6-17(7-5-16)25-19(15-9-12-23-13-10-15)18-8-3-14-2-1-11-24-20(14)21(18)26/h1-13,19,25-26H/p+2