10-[2,2-bis(hydroxymethyl)-3-oxidanyl-propyl]-10-(9-oxidanidyl-9-oxidanylidene-nonyl)nonadecanedioate

Systemtic Name: 10-[2,2-bis(hydroxymethyl)-3-oxidanyl-propyl]-10-(9-oxidanidyl-9-oxidanylidene-nonyl)nonadecanedioate Openeye Name: 10-[3-hydroxy-2,2-bis(hydroxymethyl)propyl]-10-(9-oxido-9-oxo-nonyl)nonadecanedioate CAS Name: 10-[3-hydroxy-2,2-bis(hydroxymethyl)propyl]-10-(9-oxido-9-oxononyl)nonadecanedioate IUPAC Name: 10-[3-hydroxy-2,2-bis(hydroxymethyl)propyl]-10-(9-oxido-9-oxononyl)nonadecanedioate Traditional Name: 10-(3-hydroxy-2,2-dimethylol-propyl)-10-(9-keto-9-oxido-nonyl)nonadecanedioate Formula: C33H59O9-3 MolecularWeight: 599.81616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CCCCC(CCCCCCCCC(=O)[O-])(CCCCCCCCC(=O)[O-])CC(CO)(CO)CO)CCCC(=O)[O-]

Isomeric SMILES

C(CCCCC(CCCCCCCCC(=O)[O-])(CCCCCCCCC(=O)[O-])CC(CO)(CO)CO)CCCC(=O)[O-]

InChI

InChI=1S/C33H62O9/c34-26-33(27-35,28-36)25-32(22-16-10-4-1-7-13-19-29(37)38,23-17-11-5-2-8-14-20-30(39)40)24-18-12-6-3-9-15-21-31(41)42/h34-36H,1-28H2,(H,37,38)(H,39,40)(H,41,42)/p-3