(3R,4R,5S)-4-acetamido-5-oxidanyl-3-propoxy-bicyclo[2.2.2]octane-1-carboxylic acid

Systemtic Name: (3R,4R,5S)-4-acetamido-5-oxidanyl-3-propoxy-bicyclo[2.2.2]octane-1-carboxylic acid Openeye Name: (3R,4R,5S)-4-acetamido-5-hydroxy-3-propoxy-bicyclo[2.2.2]octane-1-carboxylic acid CAS Name: (3R,4R,5S)-4-acetamido-5-hydroxy-3-propoxy-1-bicyclo[2.2.2]octanecarboxylic acid IUPAC Name: (3R,4R,5S)-4-acetamido-5-hydroxy-3-propoxybicyclo[2.2.2]octane-1-carboxylic acid Traditional Name: (3R,4R,5S)-4-acetamido-5-hydroxy-3-propoxy-bicyclo[2.2.2]octane-1-carboxylic acid Formula: C14H23NO5 MolecularWeight: 285.33612

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1CC2(CCC1(C(C2)O)NC(=O)C)C(=O)O

Isomeric SMILES

CCCO[C@@H]1CC2(CC[C@]1([C@H](C2)O)NC(=O)C)C(=O)O

InChI

InChI=1S/C14H23NO5/c1-3-6-20-11-8-13(12(18)19)4-5-14(11,10(17)7-13)15-9(2)16/h10-11,17H,3-8H2,1-2H3,(H,15,16)(H,18,19)/t10-,11+,13?,14+/m0/s1