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

Systemtic Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(2-nitrophenyl)methyl]quinolin-8-ol Openeye Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(2-nitrophenyl)methyl]quinolin-8-ol CAS Name: 7-[(R)-[(4-methyl-2-pyridin-1-iumyl)amino]-(2-nitrophenyl)methyl]-8-quinolinol IUPAC Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(2-nitrophenyl)methyl]quinolin-8-ol Traditional Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(2-nitrophenyl)methyl]quinolin-8-ol Formula: C22H19N4O3+ MolecularWeight: 387.41126

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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=C4[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C22H18N4O3/c1-14-10-12-23-19(13-14)25-21(16-6-2-3-7-18(16)26(28)29)17-9-8-15-5-4-11-24-20(15)22(17)27/h2-13,21,27H,1H3,(H,23,25)/p+1/t21-/m1/s1