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

Systemtic Name: 7-[(R)-(3-phenoxyphenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol Openeye Name: 7-[(R)-(3-phenoxyphenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol CAS Name: 7-[(R)-(3-phenoxyphenyl)-(2-pyridin-1-iumylamino)methyl]-8-quinolinol IUPAC Name: 7-[(R)-(3-phenoxyphenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol Traditional Name: 7-[(R)-(3-phenoxyphenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol Formula: C27H22N3O2+ MolecularWeight: 420.48248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)C(C3=C(C4=C(C=CC=N4)C=C3)O)NC5=CC=CC=[NH+]5

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)[C@H](C3=C(C4=C(C=CC=N4)C=C3)O)NC5=CC=CC=[NH+]5

InChI

InChI=1S/C27H21N3O2/c31-27-23(15-14-19-9-7-17-29-26(19)27)25(30-24-13-4-5-16-28-24)20-8-6-12-22(18-20)32-21-10-2-1-3-11-21/h1-18,25,31H,(H,28,30)/p+1/t25-/m1/s1