7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(6-methylpyridin-2-yl)methyl]quinolin-8-olate

Systemtic Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(6-methylpyridin-2-yl)methyl]quinolin-8-olate Openeye Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(6-methyl-2-pyridyl)methyl]quinolin-8-olate CAS Name: 7-[(R)-[(4-methyl-2-pyridin-1-iumyl)amino]-(6-methyl-2-pyridinyl)methyl]-8-quinolinolate IUPAC Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(6-methylpyridin-2-yl)methyl]quinolin-8-olate Traditional Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(6-methyl-2-pyridyl)methyl]quinolin-8-olate Formula: C22H20N4O MolecularWeight: 356.4204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C=C1)NC(C2=C(C3=C(C=CC=N3)C=C2)[O-])C4=CC=CC(=N4)C

Isomeric SMILES

CC1=CC(=[NH+]C=C1)N[C@H](C2=C(C3=C(C=CC=N3)C=C2)[O-])C4=CC=CC(=N4)C

InChI

InChI=1S/C22H20N4O/c1-14-10-12-23-19(13-14)26-21(18-7-3-5-15(2)25-18)17-9-8-16-6-4-11-24-20(16)22(17)27/h3-13,21,27H,1-2H3,(H,23,26)/t21-/m1/s1