6,7-bis(oxidanyl)-6-(2-oxidanylidenebutyl)pentacosane-5,8-dione

Systemtic Name: 6,7-bis(oxidanyl)-6-(2-oxidanylidenebutyl)pentacosane-5,8-dione Openeye Name: 6,7-dihydroxy-6-(2-oxobutyl)pentacosane-5,8-dione CAS Name: 6,7-dihydroxy-6-(2-oxobutyl)pentacosane-5,8-dione IUPAC Name: 6,7-dihydroxy-6-(2-oxobutyl)pentacosane-5,8-dione Traditional Name: 6,7-dihydroxy-6-(2-ketobutyl)pentacosane-5,8-dione Formula: C29H54O5 MolecularWeight: 482.73606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C(C(CC(=O)CC)(C(=O)CCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C(C(CC(=O)CC)(C(=O)CCCC)O)O

InChI

InChI=1S/C29H54O5/c1-4-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26(31)28(33)29(34,24-25(30)6-3)27(32)23-8-5-2/h28,33-34H,4-24H2,1-3H3