7-[(R)-(2-chloranyl-6-fluoranyl-phenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol

Systemtic Name: 7-[(R)-(2-chloranyl-6-fluoranyl-phenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol Openeye Name: 7-[(R)-(2-chloro-6-fluoro-phenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol CAS Name: 7-[(R)-(2-chloro-6-fluorophenyl)-(2-pyridin-1-iumylamino)methyl]-8-quinolinol IUPAC Name: 7-[(R)-(2-chloro-6-fluorophenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol Traditional Name: 7-[(R)-(2-chloro-6-fluoro-phenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol Formula: C21H16ClFN3O+ MolecularWeight: 380.822643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C(=C1)NC(C2=C(C3=C(C=CC=N3)C=C2)O)C4=C(C=CC=C4Cl)F

Isomeric SMILES

C1=CC=[NH+]C(=C1)N[C@H](C2=C(C3=C(C=CC=N3)C=C2)O)C4=C(C=CC=C4Cl)F

InChI

InChI=1S/C21H15ClFN3O/c22-15-6-3-7-16(23)18(15)20(26-17-8-1-2-11-24-17)14-10-9-13-5-4-12-25-19(13)21(14)27/h1-12,20,27H,(H,24,26)/p+1/t20-/m1/s1