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

Systemtic Name: 7-[[(4-methylpyridin-1-ium-2-yl)amino]-pyridin-1-ium-3-yl-methyl]quinolin-1-ium-8-ol Openeye Name: 7-[[(4-methylpyridin-1-ium-2-yl)amino]-pyridin-1-ium-3-yl-methyl]quinolin-1-ium-8-ol CAS Name: 7-[[(4-methyl-2-pyridin-1-iumyl)amino]-(3-pyridin-1-iumyl)methyl]-8-quinolin-1-iumol IUPAC Name: 7-[[(4-methylpyridin-1-ium-2-yl)amino]-pyridin-1-ium-3-ylmethyl]quinolin-1-ium-8-ol Traditional Name: 7-[[(4-methylpyridin-1-ium-2-yl)amino]-pyridin-1-ium-3-yl-methyl]quinolin-1-ium-8-ol Formula: C21H21N4O+3 MolecularWeight: 345.41764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C=C1)NC(C2=C[NH+]=CC=C2)C3=C(C4=C(C=CC=[NH+]4)C=C3)O

Isomeric SMILES

CC1=CC(=[NH+]C=C1)NC(C2=C[NH+]=CC=C2)C3=C(C4=C(C=CC=[NH+]4)C=C3)O

InChI

InChI=1S/C21H18N4O/c1-14-8-11-23-18(12-14)25-19(16-5-2-9-22-13-16)17-7-6-15-4-3-10-24-20(15)21(17)26/h2-13,19,26H,1H3,(H,23,25)/p+3