7-[(R)-(3-ethoxy-4-oxidanyl-phenyl)-[(6-methylpyridin-1-ium-2-yl)amino]methyl]-2-methyl-quinolin-8-ol

Systemtic Name: 7-[(R)-(3-ethoxy-4-oxidanyl-phenyl)-[(6-methylpyridin-1-ium-2-yl)amino]methyl]-2-methyl-quinolin-8-ol Openeye Name: 7-[(R)-(3-ethoxy-4-hydroxy-phenyl)-[(6-methylpyridin-1-ium-2-yl)amino]methyl]-2-methyl-quinolin-8-ol CAS Name: 7-[(R)-(3-ethoxy-4-hydroxyphenyl)-[(6-methyl-2-pyridin-1-iumyl)amino]methyl]-2-methyl-8-quinolinol IUPAC Name: 7-[(R)-(3-ethoxy-4-hydroxyphenyl)-[(6-methylpyridin-1-ium-2-yl)amino]methyl]-2-methylquinolin-8-ol Traditional Name: 7-[(R)-(3-ethoxy-4-hydroxy-phenyl)-[(6-methylpyridin-1-ium-2-yl)amino]methyl]-2-methyl-quinolin-8-ol Formula: C25H26N3O3+ MolecularWeight: 416.49224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C2=C(C3=C(C=CC(=N3)C)C=C2)O)NC4=CC=CC(=[NH+]4)C)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)[C@H](C2=C(C3=C(C=CC(=N3)C)C=C2)O)NC4=CC=CC(=[NH+]4)C)O

InChI

InChI=1S/C25H25N3O3/c1-4-31-21-14-18(11-13-20(21)29)23(28-22-7-5-6-15(2)26-22)19-12-10-17-9-8-16(3)27-24(17)25(19)30/h5-14,23,29-30H,4H2,1-3H3,(H,26,28)/p+1/t23-/m1/s1