(2E,6E)-2-bromanyl-8-oxidanyl-octa-2,6-dien-4-ynoic acid

Systemtic Name: (2E,6E)-2-bromanyl-8-oxidanyl-octa-2,6-dien-4-ynoic acid Openeye Name: (2E,6E)-2-bromo-8-hydroxy-octa-2,6-dien-4-ynoic acid CAS Name: (2E,6E)-2-bromo-8-hydroxyocta-2,6-dien-4-ynoic acid IUPAC Name: (2E,6E)-2-bromo-8-hydroxyocta-2,6-dien-4-ynoic acid Traditional Name: (2E,6E)-2-bromo-8-hydroxy-octa-2,6-dien-4-ynoic acid Formula: C8H7BrO3 MolecularWeight: 231.04338

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Descriptors Computed from Structure

Canonical SMILES:

C(C=CC#CC=C(C(=O)O)Br)O

Isomeric SMILES

C(/C=C/C#C/C=C(\C(=O)O)/Br)O

InChI

InChI=1S/C8H7BrO3/c9-7(8(11)12)5-3-1-2-4-6-10/h2,4-5,10H,6H2,(H,11,12)/b4-2+,7-5+