8,21-dimethyl-1,4,7,10,13,16,19-heptaoxacyclohenicosane-2,6-dione

Systemtic Name: 8,21-dimethyl-1,4,7,10,13,16,19-heptaoxacyclohenicosane-2,6-dione Openeye Name: 8,21-dimethyl-1,4,7,10,13,16,19-heptaoxacyclohenicosane-2,6-dione CAS Name: 8,21-dimethyl-1,4,7,10,13,16,19-heptaoxacycloheneicosane-2,6-dione IUPAC Name: 8,21-dimethyl-1,4,7,10,13,16,19-heptaoxacyclohenicosane-2,6-dione Traditional Name: 8,21-dimethyl-1,4,7,10,13,16,19-heptaoxacycloheneicosane-2,6-quinone Formula: C16H28O9 MolecularWeight: 364.38812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1COCCOCCOCCOCC(OC(=O)COCC(=O)O1)C

Isomeric SMILES

CC1COCCOCCOCCOCC(OC(=O)COCC(=O)O1)C

InChI

InChI=1S/C16H28O9/c1-13-9-21-7-5-19-3-4-20-6-8-22-10-14(2)25-16(18)12-23-11-15(17)24-13/h13-14H,3-12H2,1-2H3