[5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-2,5-dihydrofuran-2-yl]methyl 1-methylpyridin-1-ium-3-carboxylate

Systemtic Name: [5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-2,5-dihydrofuran-2-yl]methyl 1-methylpyridin-1-ium-3-carboxylate Openeye Name: [5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl 1-methylpyridin-1-ium-3-carboxylate CAS Name: 1-methyl-3-pyridin-1-iumcarboxylic acid [5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2,5-dihydrofuran-2-yl]methyl ester IUPAC Name: [5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl 1-methylpyridin-1-ium-3-carboxylate Traditional Name: 1-methylpyridin-1-ium-3-carboxylic acid [5-(2,4-diketo-5-methyl-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl ester Formula: C17H18N3O5+ MolecularWeight: 344.34192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2C=CC(O2)COC(=O)C3=C[N+](=CC=C3)C

Isomeric SMILES

CC1=CN(C(=O)NC1=O)C2C=CC(O2)COC(=O)C3=C[N+](=CC=C3)C

InChI

InChI=1S/C17H17N3O5/c1-11-8-20(17(23)18-15(11)21)14-6-5-13(25-14)10-24-16(22)12-4-3-7-19(2)9-12/h3-9,13-14H,10H2,1-2H3/p+1