methyl 6,8,8-trimethyl-2-oxidanylidene-8-azoniabicyclo[3.2.1]oct-3-ene-6-carboxylate iodide

Systemtic Name: methyl 6,8,8-trimethyl-2-oxidanylidene-8-azoniabicyclo[3.2.1]oct-3-ene-6-carboxylate iodide Openeye Name: methyl 6,8,8-trimethyl-2-oxo-8-azoniabicyclo[3.2.1]oct-3-ene-6-carboxylate iodide CAS Name: 6,8,8-trimethyl-2-oxo-8-azoniabicyclo[3.2.1]oct-3-ene-6-carboxylic acid methyl ester iodide IUPAC Name: methyl 6,8,8-trimethyl-2-oxo-8-azoniabicyclo[3.2.1]oct-3-ene-6-carboxylate iodide Traditional Name: 2-keto-6,8,8-trimethyl-8-azoniabicyclo[3.2.1]oct-3-ene-6-carboxylic acid methyl ester iodide Formula: C12H18INO3 MolecularWeight: 351.18069

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2C(=O)C=CC1[N+]2(C)C)C(=O)OC.[I-]

Isomeric SMILES

CC1(CC2C(=O)C=CC1[N+]2(C)C)C(=O)OC.[I-]

InChI

InChI=1S/C12H18NO3.HI/c1-12(11(15)16-4)7-8-9(14)5-6-10(12)13(8,2)3;/h5-6,8,10H,7H2,1-4H3;1H/q+1;/p-1