6-pyridin-1-ium-1-yloxycarbonylcyclohex-3-ene-1-carboxylate

Systemtic Name: 6-pyridin-1-ium-1-yloxycarbonylcyclohex-3-ene-1-carboxylate Openeye Name: 6-pyridin-1-ium-1-yloxycarbonylcyclohex-3-ene-1-carboxylate CAS Name: 6-[oxo(1-pyridin-1-iumyloxy)methyl]-1-cyclohex-3-enecarboxylate IUPAC Name: 6-pyridin-1-ium-1-yloxycarbonylcyclohex-3-ene-1-carboxylate Traditional Name: 6-pyridin-1-ium-1-yloxycarbonylcyclohex-3-ene-1-carboxylate Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)[O-])C(=O)O[N+]2=CC=CC=C2

Isomeric SMILES

C1C=CCC(C1C(=O)[O-])C(=O)O[N+]2=CC=CC=C2

InChI

InChI=1S/C13H13NO4/c15-12(16)10-6-2-3-7-11(10)13(17)18-14-8-4-1-5-9-14/h1-5,8-11H,6-7H2