7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(3-nitrophenyl)methyl]quinolin-8-ol

Systemtic Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(3-nitrophenyl)methyl]quinolin-8-ol Openeye Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(3-nitrophenyl)methyl]quinolin-8-ol CAS Name: 7-[(R)-[(4-methyl-2-pyridin-1-iumyl)amino]-(3-nitrophenyl)methyl]-8-quinolinol IUPAC Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(3-nitrophenyl)methyl]quinolin-8-ol Traditional Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(3-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=CC(=CC=C2)[N+](=O)[O-])C3=C(C4=C(C=CC=N4)C=C3)O

Isomeric SMILES

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

InChI

InChI=1S/C22H18N4O3/c1-14-9-11-23-19(12-14)25-20(16-4-2-6-17(13-16)26(28)29)18-8-7-15-5-3-10-24-21(15)22(18)27/h2-13,20,27H,1H3,(H,23,25)/p+1/t20-/m1/s1