5-[(4-methylpiperidin-1-ium-1-yl)methyl]-2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylate

Systemtic Name: 5-[(4-methylpiperidin-1-ium-1-yl)methyl]-2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylate Openeye Name: 5-[(4-methylpiperidin-1-ium-1-yl)methyl]-2,4-dioxo-1H-pyrimidine-6-carboxylate CAS Name: 5-[(4-methyl-1-piperidin-1-iumyl)methyl]-2,4-dioxo-1H-pyrimidine-6-carboxylate IUPAC Name: 5-[(4-methylpiperidin-1-ium-1-yl)methyl]-2,4-dioxo-1H-pyrimidine-6-carboxylate Traditional Name: 2,4-diketo-5-[(4-methylpiperidin-1-ium-1-yl)methyl]-1H-pyrimidine-6-carboxylate Formula: C12H17N3O4 MolecularWeight: 267.28108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=C(NC(=O)NC2=O)C(=O)[O-]

Isomeric SMILES

CC1CC[NH+](CC1)CC2=C(NC(=O)NC2=O)C(=O)[O-]

InChI

InChI=1S/C12H17N3O4/c1-7-2-4-15(5-3-7)6-8-9(11(17)18)13-12(19)14-10(8)16/h7H,2-6H2,1H3,(H,17,18)(H2,13,14,16,19)