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

Systemtic Name: 4-[[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]methyl]benzoic acid Openeye Name: 4-[[(4,5-dibromothiophene-2-carbonyl)amino]methyl]benzoic acid CAS Name: 4-[[[(4,5-dibromo-2-thiophenyl)-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(4,5-dibromothiophene-2-carbonyl)amino]methyl]benzoic acid Traditional Name: 4-[[(4,5-dibromothiophene-2-carbonyl)amino]methyl]benzoic acid Formula: C13H9Br2NO3S MolecularWeight: 419.08846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC(=C(S2)Br)Br)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC(=C(S2)Br)Br)C(=O)O

InChI

InChI=1S/C13H9Br2NO3S/c14-9-5-10(20-11(9)15)12(17)16-6-7-1-3-8(4-2-7)13(18)19/h1-5H,6H2,(H,16,17)(H,18,19)