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

Systemtic Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-pyridin-4-yl-methyl]quinolin-8-olate Openeye Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(4-pyridyl)methyl]quinolin-8-olate CAS Name: 7-[(R)-[(4-methyl-2-pyridin-1-iumyl)amino]-pyridin-4-ylmethyl]-8-quinolinolate IUPAC Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-pyridin-4-ylmethyl]quinolin-8-olate Traditional Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(4-pyridyl)methyl]quinolin-8-olate Formula: C21H18N4O MolecularWeight: 342.39382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C=C1)NC(C2=CC=NC=C2)C3=C(C4=C(C=CC=N4)C=C3)[O-]

Isomeric SMILES

CC1=CC(=[NH+]C=C1)N[C@H](C2=CC=NC=C2)C3=C(C4=C(C=CC=N4)C=C3)[O-]

InChI

InChI=1S/C21H18N4O/c1-14-6-12-23-18(13-14)25-19(16-7-10-22-11-8-16)17-5-4-15-3-2-9-24-20(15)21(17)26/h2-13,19,26H,1H3,(H,23,25)/t19-/m1/s1