3-[(2,3-dimethyl-5-bicyclo[2.2.1]heptanyl)carbonyloxymethyl]adamantane-1-carboxylic acid

Systemtic Name: 3-[(2,3-dimethyl-5-bicyclo[2.2.1]heptanyl)carbonyloxymethyl]adamantane-1-carboxylic acid Openeye Name: 3-[(5,6-dimethylnorbornane-2-carbonyl)oxymethyl]adamantane-1-carboxylic acid CAS Name: 3-[[(2,3-dimethyl-5-bicyclo[2.2.1]heptanyl)-oxomethoxy]methyl]-1-adamantanecarboxylic acid IUPAC Name: 3-[(2,3-dimethylbicyclo[2.2.1]heptane-5-carbonyl)oxymethyl]adamantane-1-carboxylic acid Traditional Name: 3-[(5,6-dimethylnorbornane-2-carbonyl)oxymethyl]adamantane-1-carboxylic acid Formula: C22H32O4 MolecularWeight: 360.48708

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2CC1CC2C(=O)OCC34CC5CC(C3)CC(C5)(C4)C(=O)O)C

Isomeric SMILES

CC1C(C2CC1CC2C(=O)OCC34CC5CC(C3)CC(C5)(C4)C(=O)O)C

InChI

InChI=1S/C22H32O4/c1-12-13(2)17-4-16(12)5-18(17)19(23)26-11-21-6-14-3-15(7-21)9-22(8-14,10-21)20(24)25/h12-18H,3-11H2,1-2H3,(H,24,25)