5-(3-oxidanylpentan-3-yl)adamantane-1,3-dicarboxylic acid

Systemtic Name: 5-(3-oxidanylpentan-3-yl)adamantane-1,3-dicarboxylic acid Openeye Name: 5-(1-ethyl-1-hydroxy-propyl)adamantane-1,3-dicarboxylic acid CAS Name: 5-(3-hydroxypentan-3-yl)adamantane-1,3-dicarboxylic acid IUPAC Name: 5-(3-hydroxypentan-3-yl)adamantane-1,3-dicarboxylic acid Traditional Name: 5-(1-ethyl-1-hydroxy-propyl)adamantane-1,3-dicarboxylic acid Formula: C17H26O5 MolecularWeight: 310.38534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C12CC3CC(C1)(CC(C3)(C2)C(=O)O)C(=O)O)O

Isomeric SMILES

CCC(CC)(C12CC3CC(C1)(CC(C3)(C2)C(=O)O)C(=O)O)O

InChI

InChI=1S/C17H26O5/c1-3-17(22,4-2)16-7-11-5-14(9-16,12(18)19)8-15(6-11,10-16)13(20)21/h11,22H,3-10H2,1-2H3,(H,18,19)(H,20,21)