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

Systemtic Name: 2-methyl-7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-pyridin-4-yl-methyl]quinolin-8-olate Openeye Name: 2-methyl-7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(4-pyridyl)methyl]quinolin-8-olate CAS Name: 2-methyl-7-[(R)-[(4-methyl-2-pyridin-1-iumyl)amino]-pyridin-4-ylmethyl]-8-quinolinolate IUPAC Name: 2-methyl-7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-pyridin-4-ylmethyl]quinolin-8-olate Traditional Name: 2-methyl-7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(4-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=CC=NC=C2)C3=C(C4=C(C=CC(=N4)C)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)C=C3)[O-]

InChI

InChI=1S/C22H20N4O/c1-14-7-12-24-19(13-14)26-20(17-8-10-23-11-9-17)18-6-5-16-4-3-15(2)25-21(16)22(18)27/h3-13,20,27H,1-2H3,(H,24,26)/t20-/m1/s1