2-[(3E,5E)-6-bromanyl-2-oxidanyl-hepta-3,5-dienyl]-1,3-oxazole-4-carboxylic acid

Systemtic Name: 2-[(3E,5E)-6-bromanyl-2-oxidanyl-hepta-3,5-dienyl]-1,3-oxazole-4-carboxylic acid Openeye Name: 2-[(3E,5E)-6-bromo-2-hydroxy-hepta-3,5-dienyl]oxazole-4-carboxylic acid CAS Name: 2-[(3E,5E)-6-bromo-2-hydroxyhepta-3,5-dienyl]-4-oxazolecarboxylic acid IUPAC Name: 2-[(3E,5E)-6-bromo-2-hydroxyhepta-3,5-dienyl]-1,3-oxazole-4-carboxylic acid Traditional Name: 2-[(3E,5E)-6-bromo-2-hydroxy-hepta-3,5-dienyl]oxazole-4-carboxylic acid Formula: C11H12BrNO4 MolecularWeight: 302.12128

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC=CC(CC1=NC(=CO1)C(=O)O)O)Br

Isomeric SMILES

C/C(=C\C=C\C(CC1=NC(=CO1)C(=O)O)O)/Br

InChI

InChI=1S/C11H12BrNO4/c1-7(12)3-2-4-8(14)5-10-13-9(6-17-10)11(15)16/h2-4,6,8,14H,5H2,1H3,(H,15,16)/b4-2+,7-3+