2-[2-(4-bromanylphenoxy)ethanoylamino]terephthalic acid

Systemtic Name: 2-[2-(4-bromanylphenoxy)ethanoylamino]terephthalic acid Openeye Name: 2-[[2-(4-bromophenoxy)acetyl]amino]terephthalic acid CAS Name: 2-[[2-(4-bromophenoxy)-1-oxoethyl]amino]terephthalic acid IUPAC Name: 2-[[2-(4-bromophenoxy)acetyl]amino]terephthalic acid Traditional Name: 2-[[2-(4-bromophenoxy)acetyl]amino]terephthalic acid Formula: C16H12BrNO6 MolecularWeight: 394.17358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1OCC(=O)NC2=C(C=CC(=C2)C(=O)O)C(=O)O)Br

InChI

InChI=1S/C16H12BrNO6/c17-10-2-4-11(5-3-10)24-8-14(19)18-13-7-9(15(20)21)1-6-12(13)16(22)23/h1-7H,8H2,(H,18,19)(H,20,21)(H,22,23)