7-[(3,4-diethoxyphenyl)-[(4-methylpyridin-1-ium-2-yl)amino]methyl]quinolin-1-ium-8-ol

Systemtic Name: 7-[(3,4-diethoxyphenyl)-[(4-methylpyridin-1-ium-2-yl)amino]methyl]quinolin-1-ium-8-ol Openeye Name: 7-[(3,4-diethoxyphenyl)-[(4-methylpyridin-1-ium-2-yl)amino]methyl]quinolin-1-ium-8-ol CAS Name: 7-[(3,4-diethoxyphenyl)-[(4-methyl-2-pyridin-1-iumyl)amino]methyl]-8-quinolin-1-iumol IUPAC Name: 7-[(3,4-diethoxyphenyl)-[(4-methylpyridin-1-ium-2-yl)amino]methyl]quinolin-1-ium-8-ol Traditional Name: 7-[(3,4-diethoxyphenyl)-[(4-methylpyridin-1-ium-2-yl)amino]methyl]quinolin-1-ium-8-ol Formula: C26H29N3O3+2 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C2=C(C3=C(C=CC=[NH+]3)C=C2)O)NC4=[NH+]C=CC(=C4)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C2=C(C3=C(C=CC=[NH+]3)C=C2)O)NC4=[NH+]C=CC(=C4)C)OCC

InChI

InChI=1S/C26H27N3O3/c1-4-31-21-11-9-19(16-22(21)32-5-2)24(29-23-15-17(3)12-14-27-23)20-10-8-18-7-6-13-28-25(18)26(20)30/h6-16,24,30H,4-5H2,1-3H3,(H,27,29)/p+2