2-(2,4-dimethylquinolin-3-yl)-N-(3-oxidanylpyridin-1-ium-2-yl)ethanamide

Systemtic Name: 2-(2,4-dimethylquinolin-3-yl)-N-(3-oxidanylpyridin-1-ium-2-yl)ethanamide Openeye Name: 2-(2,4-dimethyl-3-quinolyl)-N-(3-hydroxypyridin-1-ium-2-yl)acetamide CAS Name: 2-(2,4-dimethyl-3-quinolinyl)-N-(3-hydroxy-2-pyridin-1-iumyl)acetamide IUPAC Name: 2-(2,4-dimethylquinolin-3-yl)-N-(3-hydroxypyridin-1-ium-2-yl)acetamide Traditional Name: 2-(2,4-dimethyl-3-quinolyl)-N-(3-hydroxypyridin-1-ium-2-yl)acetamide Formula: C18H18N3O2+ MolecularWeight: 308.35442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)C)CC(=O)NC3=C(C=CC=[NH+]3)O

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)C)CC(=O)NC3=C(C=CC=[NH+]3)O

InChI

InChI=1S/C18H17N3O2/c1-11-13-6-3-4-7-15(13)20-12(2)14(11)10-17(23)21-18-16(22)8-5-9-19-18/h3-9,22H,10H2,1-2H3,(H,19,21,23)/p+1