2-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]terephthalic acid

Systemtic Name: 2-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]terephthalic acid Openeye Name: 2-[(4,5-dibromothiophene-2-carbonyl)amino]terephthalic acid CAS Name: 2-[[(4,5-dibromo-2-thiophenyl)-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[(4,5-dibromothiophene-2-carbonyl)amino]terephthalic acid Traditional Name: 2-[(4,5-dibromothiophene-2-carbonyl)amino]terephthalic acid Formula: C13H7Br2NO5S MolecularWeight: 449.07138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)NC(=O)C2=CC(=C(S2)Br)Br)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)NC(=O)C2=CC(=C(S2)Br)Br)C(=O)O

InChI

InChI=1S/C13H7Br2NO5S/c14-7-4-9(22-10(7)15)11(17)16-8-3-5(12(18)19)1-2-6(8)13(20)21/h1-4H,(H,16,17)(H,18,19)(H,20,21)