3-octan-4-ylbicyclo[2.2.2]octane-4-carboxylic acid

Systemtic Name: 3-octan-4-ylbicyclo[2.2.2]octane-4-carboxylic acid Openeye Name: 3-(1-propylpentyl)bicyclo[2.2.2]octane-4-carboxylic acid CAS Name: 3-octan-4-yl-4-bicyclo[2.2.2]octanecarboxylic acid IUPAC Name: 3-octan-4-ylbicyclo[2.2.2]octane-4-carboxylic acid Traditional Name: 3-(1-propylpentyl)bicyclo[2.2.2]octane-4-carboxylic acid Formula: C17H30O2 MolecularWeight: 266.4189

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)C1CC2CCC1(CC2)C(=O)O

Isomeric SMILES

CCCCC(CCC)C1CC2CCC1(CC2)C(=O)O

InChI

InChI=1S/C17H30O2/c1-3-5-7-14(6-4-2)15-12-13-8-10-17(15,11-9-13)16(18)19/h13-15H,3-12H2,1-2H3,(H,18,19)