(1S,6R)-6-(pyridin-2-ylcarbamoyl)cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6R)-6-(pyridin-2-ylcarbamoyl)cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6R)-6-(2-pyridylcarbamoyl)cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-6-[oxo-(2-pyridinylamino)methyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6R)-6-(pyridin-2-ylcarbamoyl)cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-6-(2-pyridylcarbamoyl)cyclohex-3-ene-1-carboxylate Formula: C13H13N2O3- MolecularWeight: 245.25392

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)NC2=CC=CC=N2)C(=O)[O-]

Isomeric SMILES

C1C=CC[C@@H]([C@@H]1C(=O)NC2=CC=CC=N2)C(=O)[O-]

InChI

InChI=1S/C13H14N2O3/c16-12(15-11-7-3-4-8-14-11)9-5-1-2-6-10(9)13(17)18/h1-4,7-10H,5-6H2,(H,17,18)(H,14,15,16)/p-1/t9-,10+/m1/s1