3-[(5-bromanylthiophen-3-yl)carbonylamino]benzoic acid

Systemtic Name: 3-[(5-bromanylthiophen-3-yl)carbonylamino]benzoic acid Openeye Name: 3-[(5-bromothiophene-3-carbonyl)amino]benzoic acid CAS Name: 3-[[(5-bromo-3-thiophenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 3-[(5-bromothiophene-3-carbonyl)amino]benzoic acid Traditional Name: 3-[(5-bromothiophene-3-carbonyl)amino]benzoic acid Formula: C12H8BrNO3S MolecularWeight: 326.16582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CSC(=C2)Br)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CSC(=C2)Br)C(=O)O

InChI

InChI=1S/C12H8BrNO3S/c13-10-5-8(6-18-10)11(15)14-9-3-1-2-7(4-9)12(16)17/h1-6H,(H,14,15)(H,16,17)