4-[[(5-bromanylthiophen-2-yl)carbonylamino]methyl]benzoate

Systemtic Name: 4-[[(5-bromanylthiophen-2-yl)carbonylamino]methyl]benzoate Openeye Name: 4-[[(5-bromothiophene-2-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[(5-bromo-2-thiophenyl)-oxomethyl]amino]methyl]benzoate IUPAC Name: 4-[[(5-bromothiophene-2-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(5-bromothiophene-2-carbonyl)amino]methyl]benzoate Formula: C13H9BrNO3S- MolecularWeight: 339.18446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC=C(S2)Br)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC=C(S2)Br)C(=O)[O-]

InChI

InChI=1S/C13H10BrNO3S/c14-11-6-5-10(19-11)12(16)15-7-8-1-3-9(4-2-8)13(17)18/h1-6H,7H2,(H,15,16)(H,17,18)/p-1