(1R,2S)-2-(pyrimidin-2-ylcarbamoyl)cyclohexane-1-carboxylate

Systemtic Name: (1R,2S)-2-(pyrimidin-2-ylcarbamoyl)cyclohexane-1-carboxylate Openeye Name: (1R,2S)-2-(pyrimidin-2-ylcarbamoyl)cyclohexanecarboxylate CAS Name: (1R,2S)-2-[oxo-(2-pyrimidinylamino)methyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2S)-2-(pyrimidin-2-ylcarbamoyl)cyclohexane-1-carboxylate Traditional Name: (1R,2S)-2-(2-pyrimidylcarbamoyl)cyclohexanecarboxylate Formula: C12H14N3O3- MolecularWeight: 248.25786

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NC2=NC=CC=N2)C(=O)[O-]

Isomeric SMILES

C1CC[C@H]([C@H](C1)C(=O)NC2=NC=CC=N2)C(=O)[O-]

InChI

InChI=1S/C12H15N3O3/c16-10(15-12-13-6-3-7-14-12)8-4-1-2-5-9(8)11(17)18/h3,6-9H,1-2,4-5H2,(H,17,18)(H,13,14,15,16)/p-1/t8-,9+/m0/s1