1-[[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]sulfonyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]sulfonyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2,4-dioxo-1H-pyrimidin-5-yl)sulfonyl]piperidine-3-carboxylic acid CAS Name: 1-[(2,4-dioxo-1H-pyrimidin-5-yl)sulfonyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2,4-dioxo-1H-pyrimidin-5-yl)sulfonyl]piperidine-3-carboxylic acid Traditional Name: 1-[(2,4-diketo-1H-pyrimidin-5-yl)sulfonyl]nipecotic acid Formula: C10H13N3O6S MolecularWeight: 303.29172

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CNC(=O)NC2=O)C(=O)O

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CNC(=O)NC2=O)C(=O)O

InChI

InChI=1S/C10H13N3O6S/c14-8-7(4-11-10(17)12-8)20(18,19)13-3-1-2-6(5-13)9(15)16/h4,6H,1-3,5H2,(H,15,16)(H2,11,12,14,17)