3,5-bis(methoxycarbonyl)adamantane-1-carboxylic acid

Systemtic Name: 3,5-bis(methoxycarbonyl)adamantane-1-carboxylic acid Openeye Name: 3,5-bis(methoxycarbonyl)adamantane-1-carboxylic acid CAS Name: 3,5-bis(methoxycarbonyl)-1-adamantanecarboxylic acid IUPAC Name: 3,5-bis(methoxycarbonyl)adamantane-1-carboxylic acid Traditional Name: 3,5-dicarbomethoxyadamantane-1-carboxylic acid Formula: C15H20O6 MolecularWeight: 296.3157

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C12CC3CC(C1)(CC(C3)(C2)C(=O)OC)C(=O)O

Isomeric SMILES

COC(=O)C12CC3CC(C1)(CC(C3)(C2)C(=O)OC)C(=O)O

InChI

InChI=1S/C15H20O6/c1-20-11(18)14-4-9-3-13(6-14,10(16)17)7-15(5-9,8-14)12(19)21-2/h9H,3-8H2,1-2H3,(H,16,17)