17,18-bis(oxidanyl)-18-(2-propylpentanoyl)pentatriacontane-16,20-dione

Systemtic Name: 17,18-bis(oxidanyl)-18-(2-propylpentanoyl)pentatriacontane-16,20-dione Openeye Name: 17,18-dihydroxy-18-(2-propylpentanoyl)pentatriacontane-16,20-dione CAS Name: 17,18-dihydroxy-18-(1-oxo-2-propylpentyl)pentatriacontane-16,20-dione IUPAC Name: 17,18-dihydroxy-18-(2-propylpentanoyl)pentatriacontane-16,20-dione Traditional Name: 17,18-dihydroxy-18-(2-propylpentanoyl)pentatriacontane-16,20-dione Formula: C43H82O5 MolecularWeight: 679.10818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)CC(C(C(=O)CCCCCCCCCCCCCCC)O)(C(=O)C(CCC)CCC)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)CC(C(C(=O)CCCCCCCCCCCCCCC)O)(C(=O)C(CCC)CCC)O

InChI

InChI=1S/C43H82O5/c1-5-9-11-13-15-17-19-21-23-25-27-29-31-35-39(44)37-43(48,41(46)38(33-7-3)34-8-4)42(47)40(45)36-32-30-28-26-24-22-20-18-16-14-12-10-6-2/h38,42,47-48H,5-37H2,1-4H3