ethyl 4-[[3,5-bis(bromanyl)-2,6-bis(oxidanyl)phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[3,5-bis(bromanyl)-2,6-bis(oxidanyl)phenyl]carbonylamino]benzoate Openeye Name: ethyl 4-[(3,5-dibromo-2,6-dihydroxy-benzoyl)amino]benzoate CAS Name: 4-[[(3,5-dibromo-2,6-dihydroxyphenyl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3,5-dibromo-2,6-dihydroxybenzoyl)amino]benzoate Traditional Name: 4-[(3,5-dibromo-2,6-dihydroxy-benzoyl)amino]benzoic acid ethyl ester Formula: C16H13Br2NO5 MolecularWeight: 459.08612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C(=CC(=C2O)Br)Br)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C(=CC(=C2O)Br)Br)O

InChI

InChI=1S/C16H13Br2NO5/c1-2-24-16(23)8-3-5-9(6-4-8)19-15(22)12-13(20)10(17)7-11(18)14(12)21/h3-7,20-21H,2H2,1H3,(H,19,22)