2-[(1S,5R)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ylidene]ethanoate

Systemtic Name: 2-[(1S,5R)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ylidene]ethanoate Openeye Name: 2-[(1S,5R)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ylidene]acetate CAS Name: 2-[(1S,5R)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ylidene]acetate IUPAC Name: 2-[(1S,5R)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ylidene]acetate Traditional Name: 2-[(1S,5R)-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ylidene]acetate Formula: C10H15NO2 MolecularWeight: 181.2316

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1C2CCC1CC(=CC(=O)[O-])C2

Isomeric SMILES

C[NH+]1[C@@H]2CC[C@H]1CC(=CC(=O)[O-])C2

InChI

InChI=1S/C10H15NO2/c1-11-8-2-3-9(11)5-7(4-8)6-10(12)13/h6,8-9H,2-5H2,1H3,(H,12,13)/t8-,9+