2-[(1S,4R)-3-azoniabicyclo[2.2.1]heptan-3-yl]ethanoate

Systemtic Name: 2-[(1S,4R)-3-azoniabicyclo[2.2.1]heptan-3-yl]ethanoate Openeye Name: 2-[(1S,4R)-3-azoniabicyclo[2.2.1]heptan-3-yl]acetate CAS Name: 2-[(1S,4R)-3-azoniabicyclo[2.2.1]heptan-3-yl]acetate IUPAC Name: 2-[(1S,4R)-3-azoniabicyclo[2.2.1]heptan-3-yl]acetate Traditional Name: 2-[(1S,4R)-3-azoniabicyclo[2.2.1]heptan-3-yl]acetate Formula: C8H13NO2 MolecularWeight: 155.19432

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC1C[NH+]2CC(=O)[O-]

Isomeric SMILES

C1C[C@@H]2C[C@H]1C[NH+]2CC(=O)[O-]

InChI

InChI=1S/C8H13NO2/c10-8(11)5-9-4-6-1-2-7(9)3-6/h6-7H,1-5H2,(H,10,11)/t6-,7+/m0/s1