methyl 2-ethoxy-6,6-dimethyl-4-pyrrolidin-1-ium-1-ylidene-cyclohex-2-ene-1-carboxylate iodide

Systemtic Name: methyl 2-ethoxy-6,6-dimethyl-4-pyrrolidin-1-ium-1-ylidene-cyclohex-2-ene-1-carboxylate iodide Openeye Name: methyl 2-ethoxy-6,6-dimethyl-4-pyrrolidin-1-ium-1-ylidene-cyclohex-2-ene-1-carboxylate iodide CAS Name: 2-ethoxy-6,6-dimethyl-4-(1-pyrrolidin-1-iumylidene)-1-cyclohex-2-enecarboxylic acid methyl ester iodide IUPAC Name: methyl 2-ethoxy-6,6-dimethyl-4-pyrrolidin-1-ium-1-ylidenecyclohex-2-ene-1-carboxylate iodide Traditional Name: 2-ethoxy-6,6-dimethyl-4-pyrrolidin-1-ium-1-ylidene-cyclohex-2-ene-1-carboxylic acid methyl ester iodide Formula: C16H26INO3 MolecularWeight: 407.28701

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=[N+]2CCCC2)CC(C1C(=O)OC)(C)C.[I-]

Isomeric SMILES

CCOC1=CC(=[N+]2CCCC2)CC(C1C(=O)OC)(C)C.[I-]

InChI

InChI=1S/C16H26NO3.HI/c1-5-20-13-10-12(17-8-6-7-9-17)11-16(2,3)14(13)15(18)19-4;/h10,14H,5-9,11H2,1-4H3;1H/q+1;/p-1