7-[(3-fluorophenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-1-ium-8-ol

Systemtic Name: 7-[(3-fluorophenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-1-ium-8-ol Openeye Name: 7-[(3-fluorophenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-1-ium-8-ol CAS Name: 7-[(3-fluorophenyl)-(2-pyridin-1-iumylamino)methyl]-8-quinolin-1-iumol IUPAC Name: 7-[(3-fluorophenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-1-ium-8-ol Traditional Name: 7-[(3-fluorophenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-1-ium-8-ol Formula: C21H18FN3O+2 MolecularWeight: 347.385523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C(=C1)NC(C2=CC(=CC=C2)F)C3=C(C4=C(C=CC=[NH+]4)C=C3)O

Isomeric SMILES

C1=CC=[NH+]C(=C1)NC(C2=CC(=CC=C2)F)C3=C(C4=C(C=CC=[NH+]4)C=C3)O

InChI

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