7-[(3-chloranyl-4,5-dimethoxy-phenyl)-[(4-methylpyridin-1-ium-2-yl)amino]methyl]-2-methyl-quinolin-1-ium-8-ol

Systemtic Name: 7-[(3-chloranyl-4,5-dimethoxy-phenyl)-[(4-methylpyridin-1-ium-2-yl)amino]methyl]-2-methyl-quinolin-1-ium-8-ol Openeye Name: 7-[(3-chloro-4,5-dimethoxy-phenyl)-[(4-methylpyridin-1-ium-2-yl)amino]methyl]-2-methyl-quinolin-1-ium-8-ol CAS Name: 7-[(3-chloro-4,5-dimethoxyphenyl)-[(4-methyl-2-pyridin-1-iumyl)amino]methyl]-2-methyl-8-quinolin-1-iumol IUPAC Name: 7-[(3-chloro-4,5-dimethoxyphenyl)-[(4-methylpyridin-1-ium-2-yl)amino]methyl]-2-methylquinolin-1-ium-8-ol Traditional Name: 7-[(3-chloro-4,5-dimethoxy-phenyl)-[(4-methylpyridin-1-ium-2-yl)amino]methyl]-2-methyl-quinolin-1-ium-8-ol Formula: C25H26ClN3O3+2 MolecularWeight: 451.94524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C=C1)NC(C2=C(C3=C(C=CC(=[NH+]3)C)C=C2)O)C4=CC(=C(C(=C4)Cl)OC)OC

Isomeric SMILES

CC1=CC(=[NH+]C=C1)NC(C2=C(C3=C(C=CC(=[NH+]3)C)C=C2)O)C4=CC(=C(C(=C4)Cl)OC)OC

InChI

InChI=1S/C25H24ClN3O3/c1-14-9-10-27-21(11-14)29-22(17-12-19(26)25(32-4)20(13-17)31-3)18-8-7-16-6-5-15(2)28-23(16)24(18)30/h5-13,22,30H,1-4H3,(H,27,29)/p+2