ethyl (1S,2S,4R)-3-azoniabicyclo[2.2.1]heptane-2-carboxylate

Systemtic Name: ethyl (1S,2S,4R)-3-azoniabicyclo[2.2.1]heptane-2-carboxylate Openeye Name: ethyl (1S,2S,4R)-3-azoniabicyclo[2.2.1]heptane-2-carboxylate CAS Name: (1S,2S,4R)-3-azoniabicyclo[2.2.1]heptane-2-carboxylic acid ethyl ester IUPAC Name: ethyl (1S,2S,4R)-3-azoniabicyclo[2.2.1]heptane-2-carboxylate Traditional Name: (1S,2S,4R)-3-azoniabicyclo[2.2.1]heptane-2-carboxylic acid ethyl ester Formula: C9H16NO2+ MolecularWeight: 170.22884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2CCC(C2)[NH2+]1

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H]2CC[C@H](C2)[NH2+]1

InChI

InChI=1S/C9H15NO2/c1-2-12-9(11)8-6-3-4-7(5-6)10-8/h6-8,10H,2-5H2,1H3/p+1/t6-,7+,8-/m0/s1