2-[2,3-bis(oxidanyl)propyl]-3-pentyl-tetradecanedioic acid

Systemtic Name: 2-[2,3-bis(oxidanyl)propyl]-3-pentyl-tetradecanedioic acid Openeye Name: 2-(2,3-dihydroxypropyl)-3-pentyl-tetradecanedioic acid CAS Name: 2-(2,3-dihydroxypropyl)-3-pentyltetradecanedioic acid IUPAC Name: 2-(2,3-dihydroxypropyl)-3-pentyltetradecanedioic acid Traditional Name: 3-amyl-2-glyceryl-tetradecanedioic acid Formula: C22H42O6 MolecularWeight: 402.56528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCCCCCCCCC(=O)O)C(CC(CO)O)C(=O)O

Isomeric SMILES

CCCCCC(CCCCCCCCCCC(=O)O)C(CC(CO)O)C(=O)O

InChI

InChI=1S/C22H42O6/c1-2-3-10-13-18(20(22(27)28)16-19(24)17-23)14-11-8-6-4-5-7-9-12-15-21(25)26/h18-20,23-24H,2-17H2,1H3,(H,25,26)(H,27,28)