2-methyl-7-[(2-nitrophenyl)-(pyridin-2-ylamino)methyl]quinolin-1-ium-8-ol

Systemtic Name: 2-methyl-7-[(2-nitrophenyl)-(pyridin-2-ylamino)methyl]quinolin-1-ium-8-ol Openeye Name: 2-methyl-7-[(2-nitrophenyl)-(2-pyridylamino)methyl]quinolin-1-ium-8-ol CAS Name: 2-methyl-7-[(2-nitrophenyl)-(2-pyridinylamino)methyl]-8-quinolin-1-iumol IUPAC Name: 2-methyl-7-[(2-nitrophenyl)-(pyridin-2-ylamino)methyl]quinolin-1-ium-8-ol Traditional Name: 2-methyl-7-[(2-nitrophenyl)-(2-pyridylamino)methyl]quinolin-1-ium-8-ol Formula: C22H19N4O3+ MolecularWeight: 387.41126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C2=C(C=C1)C=CC(=C2O)C(C3=CC=CC=C3[N+](=O)[O-])NC4=CC=CC=N4

Isomeric SMILES

CC1=[NH+]C2=C(C=C1)C=CC(=C2O)C(C3=CC=CC=C3[N+](=O)[O-])NC4=CC=CC=N4

InChI

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