8-bromanyl-8-ethanoyl-12-oxidanyl-heptadecanoic acid

Systemtic Name: 8-bromanyl-8-ethanoyl-12-oxidanyl-heptadecanoic acid Openeye Name: 8-acetyl-8-bromo-12-hydroxy-heptadecanoic acid CAS Name: 8-acetyl-8-bromo-12-hydroxyheptadecanoic acid IUPAC Name: 8-acetyl-8-bromo-12-hydroxyheptadecanoic acid Traditional Name: 8-acetyl-8-bromo-12-hydroxy-heptadecanoic acid Formula: C19H35BrO4 MolecularWeight: 407.3828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC(CCCCCCC(=O)O)(C(=O)C)Br)O

Isomeric SMILES

CCCCCC(CCCC(CCCCCCC(=O)O)(C(=O)C)Br)O

InChI

InChI=1S/C19H35BrO4/c1-3-4-7-11-17(22)12-10-15-19(20,16(2)21)14-9-6-5-8-13-18(23)24/h17,22H,3-15H2,1-2H3,(H,23,24)