9,10-bis(bromanyl)-12-oxidanyl-octadecanoic acid

Systemtic Name: 9,10-bis(bromanyl)-12-oxidanyl-octadecanoic acid Openeye Name: 9,10-dibromo-12-hydroxy-octadecanoic acid CAS Name: 9,10-dibromo-12-hydroxyoctadecanoic acid IUPAC Name: 9,10-dibromo-12-hydroxyoctadecanoic acid Traditional Name: 9,10-dibromo-12-hydroxy-stearic acid Formula: C18H34Br2O3 MolecularWeight: 458.26876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC(C(CCCCCCCC(=O)O)Br)Br)O

Isomeric SMILES

CCCCCCC(CC(C(CCCCCCCC(=O)O)Br)Br)O

InChI

InChI=1S/C18H34Br2O3/c1-2-3-4-8-11-15(21)14-17(20)16(19)12-9-6-5-7-10-13-18(22)23/h15-17,21H,2-14H2,1H3,(H,22,23)