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

Systemtic Name: 5-chloranyl-7-[(R)-(3-fluorophenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol Openeye Name: 5-chloro-7-[(R)-(3-fluorophenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol CAS Name: 5-chloro-7-[(R)-(3-fluorophenyl)-(2-pyridin-1-iumylamino)methyl]-8-quinolinol IUPAC Name: 5-chloro-7-[(R)-(3-fluorophenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol Traditional Name: 5-chloro-7-[(R)-(3-fluorophenyl)-(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=CC(=CC=C2)F)C3=CC(=C4C=CC=NC4=C3O)Cl

Isomeric SMILES

C1=CC=[NH+]C(=C1)N[C@H](C2=CC(=CC=C2)F)C3=CC(=C4C=CC=NC4=C3O)Cl

InChI

InChI=1S/C21H15ClFN3O/c22-17-12-16(21(27)20-15(17)7-4-10-25-20)19(13-5-3-6-14(23)11-13)26-18-8-1-2-9-24-18/h1-12,19,27H,(H,24,26)/p+1/t19-/m1/s1