3-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]-4-chloranyl-benzoic acid

Systemtic Name: 3-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]-4-chloranyl-benzoic acid Openeye Name: 4-chloro-3-[(4,5-dibromothiophene-2-carbonyl)amino]benzoic acid CAS Name: 4-chloro-3-[[(4,5-dibromo-2-thiophenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[(4,5-dibromothiophene-2-carbonyl)amino]benzoic acid Traditional Name: 4-chloro-3-[(4,5-dibromothiophene-2-carbonyl)amino]benzoic acid Formula: C12H6Br2ClNO3S MolecularWeight: 439.50694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H6Br2ClNO3S/c13-6-4-9(20-10(6)14)11(17)16-8-3-5(12(18)19)1-2-7(8)15/h1-4H,(H,16,17)(H,18,19)