ethyl 2-methyl-4-[[(3-methylpyridin-1-ium-2-yl)amino]methylidene]-5-oxidanylidene-benzo[g][1]benzofuran-3-carboxylate

Systemtic Name: ethyl 2-methyl-4-[[(3-methylpyridin-1-ium-2-yl)amino]methylidene]-5-oxidanylidene-benzo[g][1]benzofuran-3-carboxylate Openeye Name: ethyl 2-methyl-4-[[(3-methylpyridin-1-ium-2-yl)amino]methylene]-5-oxo-benzo[g]benzofuran-3-carboxylate CAS Name: 2-methyl-4-[[(3-methyl-2-pyridin-1-iumyl)amino]methylidene]-5-oxo-3-benzo[g]benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-[[(3-methylpyridin-1-ium-2-yl)amino]methylidene]-5-oxobenzo[g][1]benzofuran-3-carboxylate Traditional Name: 5-keto-2-methyl-4-[[(3-methylpyridin-1-ium-2-yl)amino]methylene]benzo[g]benzofuran-3-carboxylic acid ethyl ester Formula: C23H21N2O4+ MolecularWeight: 389.42384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=CNC3=C(C=CC=[NH+]3)C)C(=O)C4=CC=CC=C42)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=CNC3=C(C=CC=[NH+]3)C)C(=O)C4=CC=CC=C42)C

InChI

InChI=1S/C23H20N2O4/c1-4-28-23(27)18-14(3)29-21-16-10-6-5-9-15(16)20(26)17(19(18)21)12-25-22-13(2)8-7-11-24-22/h5-12H,4H2,1-3H3,(H,24,25)/p+1