5-chloranyl-3-methyl-2-oxidanylidene-4-(2-oxidanylidenepropyl)-1,4-dihydropyrimidine-6-carboxylic acid

Systemtic Name: 5-chloranyl-3-methyl-2-oxidanylidene-4-(2-oxidanylidenepropyl)-1,4-dihydropyrimidine-6-carboxylic acid Openeye Name: 4-acetonyl-5-chloro-3-methyl-2-oxo-1,4-dihydropyrimidine-6-carboxylic acid CAS Name: 5-chloro-3-methyl-2-oxo-4-(2-oxopropyl)-1,4-dihydropyrimidine-6-carboxylic acid IUPAC Name: 5-chloro-3-methyl-2-oxo-4-(2-oxopropyl)-1,4-dihydropyrimidine-6-carboxylic acid Traditional Name: 4-acetonyl-5-chloro-2-keto-3-methyl-1,4-dihydropyrimidine-6-carboxylic acid Formula: C9H11ClN2O4 MolecularWeight: 246.64764

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1C(=C(NC(=O)N1C)C(=O)O)Cl

Isomeric SMILES

CC(=O)CC1C(=C(NC(=O)N1C)C(=O)O)Cl

InChI

InChI=1S/C9H11ClN2O4/c1-4(13)3-5-6(10)7(8(14)15)11-9(16)12(5)2/h5H,3H2,1-2H3,(H,11,16)(H,14,15)