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

Systemtic Name: 7-[(R)-(4-hydroxyphenyl)-[(4-methylpyridin-1-ium-2-yl)amino]methyl]quinolin-8-olate Openeye Name: 7-[(R)-(4-hydroxyphenyl)-[(4-methylpyridin-1-ium-2-yl)amino]methyl]quinolin-8-olate CAS Name: 7-[(R)-(4-hydroxyphenyl)-[(4-methyl-2-pyridin-1-iumyl)amino]methyl]-8-quinolinolate IUPAC Name: 7-[(R)-(4-hydroxyphenyl)-[(4-methylpyridin-1-ium-2-yl)amino]methyl]quinolin-8-olate Traditional Name: 7-[(R)-(4-hydroxyphenyl)-[(4-methylpyridin-1-ium-2-yl)amino]methyl]quinolin-8-olate Formula: C22H19N3O2 MolecularWeight: 357.40516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19N3O2/c1-14-10-12-23-19(13-14)25-20(16-4-7-17(26)8-5-16)18-9-6-15-3-2-11-24-21(15)22(18)27/h2-13,20,26-27H,1H3,(H,23,25)/t20-/m1/s1