6,7-bis(oxidanyl)-7-propanoyl-octacosane-5,9-dione

Systemtic Name: 6,7-bis(oxidanyl)-7-propanoyl-octacosane-5,9-dione Openeye Name: 6,7-dihydroxy-7-propanoyl-octacosane-5,9-dione CAS Name: 6,7-dihydroxy-7-(1-oxopropyl)octacosane-5,9-dione IUPAC Name: 6,7-dihydroxy-7-propanoyloctacosane-5,9-dione Traditional Name: 6,7-dihydroxy-7-propionyl-octacosane-5,9-dione Formula: C31H58O5 MolecularWeight: 510.78922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(=O)CC(C(C(=O)CCCC)O)(C(=O)CC)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(=O)CC(C(C(=O)CCCC)O)(C(=O)CC)O

InChI

InChI=1S/C31H58O5/c1-4-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27(32)26-31(36,29(34)6-3)30(35)28(33)25-8-5-2/h30,35-36H,4-26H2,1-3H3