2-[(5-bromanylthiophen-3-yl)carbonyl-methyl-amino]benzoic acid

Systemtic Name: 2-[(5-bromanylthiophen-3-yl)carbonyl-methyl-amino]benzoic acid Openeye Name: 2-[(5-bromothiophene-3-carbonyl)-methyl-amino]benzoic acid CAS Name: 2-[[(5-bromo-3-thiophenyl)-oxomethyl]-methylamino]benzoic acid IUPAC Name: 2-[(5-bromothiophene-3-carbonyl)-methylamino]benzoic acid Traditional Name: 2-[(5-bromothiophene-3-carbonyl)-methyl-amino]benzoic acid Formula: C13H10BrNO3S MolecularWeight: 340.1924

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)O)C(=O)C2=CSC(=C2)Br

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)O)C(=O)C2=CSC(=C2)Br

InChI

InChI=1S/C13H10BrNO3S/c1-15(12(16)8-6-11(14)19-7-8)10-5-3-2-4-9(10)13(17)18/h2-7H,1H3,(H,17,18)