3,5,7-tris(methoxycarbonyl)adamantane-1-carboxylic acid

Systemtic Name: 3,5,7-tris(methoxycarbonyl)adamantane-1-carboxylic acid Openeye Name: 3,5,7-tris(methoxycarbonyl)adamantane-1-carboxylic acid CAS Name: 3,5,7-tris(methoxycarbonyl)-1-adamantanecarboxylic acid IUPAC Name: 3,5,7-tris(methoxycarbonyl)adamantane-1-carboxylic acid Traditional Name: 3,5,7-tricarbomethoxyadamantane-1-carboxylic acid Formula: C17H22O8 MolecularWeight: 354.35178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C12CC3(CC(C1)(CC(C3)(C2)C(=O)OC)C(=O)OC)C(=O)O

Isomeric SMILES

COC(=O)C12CC3(CC(C1)(CC(C3)(C2)C(=O)OC)C(=O)OC)C(=O)O

InChI

InChI=1S/C17H22O8/c1-23-11(20)15-4-14(10(18)19)5-16(7-15,12(21)24-2)9-17(6-14,8-15)13(22)25-3/h4-9H2,1-3H3,(H,18,19)