2,4-bis(oxidanylidene)-5-(piperidin-1-ium-1-ylmethyl)-1H-pyrimidine-6-carboxylate

Systemtic Name: 2,4-bis(oxidanylidene)-5-(piperidin-1-ium-1-ylmethyl)-1H-pyrimidine-6-carboxylate Openeye Name: 2,4-dioxo-5-(piperidin-1-ium-1-ylmethyl)-1H-pyrimidine-6-carboxylate CAS Name: 2,4-dioxo-5-(1-piperidin-1-iumylmethyl)-1H-pyrimidine-6-carboxylate IUPAC Name: 2,4-dioxo-5-(piperidin-1-ium-1-ylmethyl)-1H-pyrimidine-6-carboxylate Traditional Name: 2,4-diketo-5-(piperidin-1-ium-1-ylmethyl)-1H-pyrimidine-6-carboxylate Formula: C11H15N3O4 MolecularWeight: 253.2545

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=C(NC(=O)NC2=O)C(=O)[O-]

Isomeric SMILES

C1CC[NH+](CC1)CC2=C(NC(=O)NC2=O)C(=O)[O-]

InChI

InChI=1S/C11H15N3O4/c15-9-7(6-14-4-2-1-3-5-14)8(10(16)17)12-11(18)13-9/h1-6H2,(H,16,17)(H2,12,13,15,18)