4-[[2-acetyloxy-3,5-bis(bromanyl)phenyl]carbonylamino]benzoic acid

Systemtic Name: 4-[[2-acetyloxy-3,5-bis(bromanyl)phenyl]carbonylamino]benzoic acid Openeye Name: 4-[(2-acetoxy-3,5-dibromo-benzoyl)amino]benzoic acid CAS Name: 4-[[(2-acetyloxy-3,5-dibromophenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(2-acetyloxy-3,5-dibromobenzoyl)amino]benzoic acid Traditional Name: 4-[(2-acetoxy-3,5-dibromo-benzoyl)amino]benzoic acid Formula: C16H11Br2NO5 MolecularWeight: 457.07024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1C(=O)NC2=CC=C(C=C2)C(=O)O)Br)Br

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1C(=O)NC2=CC=C(C=C2)C(=O)O)Br)Br

InChI

InChI=1S/C16H11Br2NO5/c1-8(20)24-14-12(6-10(17)7-13(14)18)15(21)19-11-4-2-9(3-5-11)16(22)23/h2-7H,1H3,(H,19,21)(H,22,23)