6-[[3,5-bis(bromanyl)-2-oxidanyl-phenyl]carbonylamino]hexanoic acid

Systemtic Name: 6-[[3,5-bis(bromanyl)-2-oxidanyl-phenyl]carbonylamino]hexanoic acid Openeye Name: 6-[(3,5-dibromo-2-hydroxy-benzoyl)amino]hexanoic acid CAS Name: 6-[[(3,5-dibromo-2-hydroxyphenyl)-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[(3,5-dibromo-2-hydroxybenzoyl)amino]hexanoic acid Traditional Name: 6-[(3,5-dibromo-2-hydroxy-benzoyl)amino]hexanoic acid Formula: C13H15Br2NO4 MolecularWeight: 409.0705

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Br)O)C(=O)NCCCCCC(=O)O)Br

Isomeric SMILES

C1=C(C=C(C(=C1Br)O)C(=O)NCCCCCC(=O)O)Br

InChI

InChI=1S/C13H15Br2NO4/c14-8-6-9(12(19)10(15)7-8)13(20)16-5-3-1-2-4-11(17)18/h6-7,19H,1-5H2,(H,16,20)(H,17,18)