2-(1-dodecoxy-3-dodecoxycarbonyl-1-oxidanylidene-pentadecan-3-yl)oxyethanoic acid

Systemtic Name: 2-(1-dodecoxy-3-dodecoxycarbonyl-1-oxidanylidene-pentadecan-3-yl)oxyethanoic acid Openeye Name: 2-[1-dodecoxycarbonyl-1-(2-dodecoxy-2-oxo-ethyl)tridecoxy]acetic acid CAS Name: 2-[1-dodecoxy-3-[dodecoxy(oxo)methyl]-1-oxopentadecan-3-yl]oxyacetic acid IUPAC Name: 2-(1-dodecoxy-3-dodecoxycarbonyl-1-oxopentadecan-3-yl)oxyacetic acid Traditional Name: 2-[1-(2-keto-2-lauryloxy-ethyl)-1-lauryloxycarbonyl-tridecoxy]acetic acid Formula: C42H80O7 MolecularWeight: 697.0804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CC(=O)OCCCCCCCCCCCC)(C(=O)OCCCCCCCCCCCC)OCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCC(CC(=O)OCCCCCCCCCCCC)(C(=O)OCCCCCCCCCCCC)OCC(=O)O

InChI

InChI=1S/C42H80O7/c1-4-7-10-13-16-19-22-25-28-31-34-42(49-38-39(43)44,41(46)48-36-33-30-27-24-21-18-15-12-9-6-3)37-40(45)47-35-32-29-26-23-20-17-14-11-8-5-2/h4-38H2,1-3H3,(H,43,44)