(E)-2,2-bis(bromanyl)-12-oxidanyl-octadec-9-enoic acid

Systemtic Name: (E)-2,2-bis(bromanyl)-12-oxidanyl-octadec-9-enoic acid Openeye Name: (E)-2,2-dibromo-12-hydroxy-octadec-9-enoic acid CAS Name: (E)-2,2-dibromo-12-hydroxy-9-octadecenoic acid IUPAC Name: (E)-2,2-dibromo-12-hydroxyoctadec-9-enoic acid Traditional Name: (E)-2,2-dibromo-12-hydroxy-octadec-9-enoic acid Formula: C18H32Br2O3 MolecularWeight: 456.25288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCC(C/C=C/CCCCCCC(C(=O)O)(Br)Br)O

InChI

InChI=1S/C18H32Br2O3/c1-2-3-4-10-13-16(21)14-11-8-6-5-7-9-12-15-18(19,20)17(22)23/h8,11,16,21H,2-7,9-10,12-15H2,1H3,(H,22,23)/b11-8+