5-[(S)-(2-fluorophenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-6-ol

Systemtic Name: 5-[(S)-(2-fluorophenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-6-ol Openeye Name: 5-[(S)-(2-fluorophenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-6-ol CAS Name: 5-[(S)-(2-fluorophenyl)-(2-pyridin-1-iumylamino)methyl]-6-quinolinol IUPAC Name: 5-[(S)-(2-fluorophenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-6-ol Traditional Name: 5-[(S)-(2-fluorophenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-6-ol Formula: C21H17FN3O+ MolecularWeight: 346.377583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(C2=C(C=CC3=C2C=CC=N3)O)NC4=CC=CC=[NH+]4)F

Isomeric SMILES

C1=CC=C(C(=C1)[C@H](C2=C(C=CC3=C2C=CC=N3)O)NC4=CC=CC=[NH+]4)F

InChI

InChI=1S/C21H16FN3O/c22-16-8-2-1-6-14(16)21(25-19-9-3-4-12-24-19)20-15-7-5-13-23-17(15)10-11-18(20)26/h1-13,21,26H,(H,24,25)/p+1/t21-/m1/s1