methyl (1S,5S,6R)-8,8-dimethyl-2-oxidanylidene-8-azoniabicyclo[3.2.1]oct-3-ene-6-carboxylate

Systemtic Name: methyl (1S,5S,6R)-8,8-dimethyl-2-oxidanylidene-8-azoniabicyclo[3.2.1]oct-3-ene-6-carboxylate Openeye Name: methyl (1S,5S,6R)-8,8-dimethyl-2-oxo-8-azoniabicyclo[3.2.1]oct-3-ene-6-carboxylate CAS Name: (1S,5S,6R)-8,8-dimethyl-2-oxo-8-azoniabicyclo[3.2.1]oct-3-ene-6-carboxylic acid methyl ester IUPAC Name: methyl (1S,5S,6R)-8,8-dimethyl-2-oxo-8-azoniabicyclo[3.2.1]oct-3-ene-6-carboxylate Traditional Name: (1S,5S,6R)-2-keto-8,8-dimethyl-8-azoniabicyclo[3.2.1]oct-3-ene-6-carboxylic acid methyl ester Formula: C11H16NO3+ MolecularWeight: 210.24964

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C2CC(C1C=CC2=O)C(=O)OC)C

Isomeric SMILES

C[N+]1([C@H]2C[C@H]([C@@H]1C=CC2=O)C(=O)OC)C

InChI

InChI=1S/C11H16NO3/c1-12(2)8-4-5-10(13)9(12)6-7(8)11(14)15-3/h4-5,7-9H,6H2,1-3H3/q+1/t7-,8+,9+/m1/s1