6-azanyl-1,3-dimethyl-5-[2-(3-methylimidazol-3-ium-1-yl)ethanoyl]pyrimidine-2,4-dione chloride

Systemtic Name: 6-azanyl-1,3-dimethyl-5-[2-(3-methylimidazol-3-ium-1-yl)ethanoyl]pyrimidine-2,4-dione chloride Openeye Name: 6-amino-1,3-dimethyl-5-[2-(3-methylimidazol-3-ium-1-yl)acetyl]pyrimidine-2,4-dione chloride CAS Name: 6-amino-1,3-dimethyl-5-[2-(3-methyl-1-imidazol-3-iumyl)-1-oxoethyl]pyrimidine-2,4-dione chloride IUPAC Name: 6-amino-1,3-dimethyl-5-[2-(3-methylimidazol-3-ium-1-yl)acetyl]pyrimidine-2,4-dione chloride Traditional Name: 6-amino-1,3-dimethyl-5-[2-(3-methylimidazol-3-ium-1-yl)acetyl]pyrimidine-2,4-quinone chloride Formula: C12H16ClN5O3 MolecularWeight: 313.74014

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C(=O)CN2C=C[N+](=C2)C)N.[Cl-]

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C(=O)CN2C=C[N+](=C2)C)N.[Cl-]

InChI

InChI=1S/C12H15N5O3.ClH/c1-14-4-5-17(7-14)6-8(18)9-10(13)15(2)12(20)16(3)11(9)19;/h4-5,7H,6H2,1-3H3,(H-,13,18,19);1H