6-[[3,4-bis(bromanyl)phenyl]carbonylamino]hexanoic acid

Systemtic Name: 6-[[3,4-bis(bromanyl)phenyl]carbonylamino]hexanoic acid Openeye Name: 6-[(3,4-dibromobenzoyl)amino]hexanoic acid CAS Name: 6-[[(3,4-dibromophenyl)-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[(3,4-dibromobenzoyl)amino]hexanoic acid Traditional Name: 6-[(3,4-dibromobenzoyl)amino]hexanoic acid Formula: C13H15Br2NO3 MolecularWeight: 393.0711

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NCCCCCC(=O)O)Br)Br

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NCCCCCC(=O)O)Br)Br

InChI

InChI=1S/C13H15Br2NO3/c14-10-6-5-9(8-11(10)15)13(19)16-7-3-1-2-4-12(17)18/h5-6,8H,1-4,7H2,(H,16,19)(H,17,18)