2-[methyl-[2-[tris(bromanyl)methylsulfonyl]phenyl]carbonyl-amino]ethanoic acid

Systemtic Name: 2-[methyl-[2-[tris(bromanyl)methylsulfonyl]phenyl]carbonyl-amino]ethanoic acid Openeye Name: 2-[methyl-[2-(tribromomethylsulfonyl)benzoyl]amino]acetic acid CAS Name: 2-[methyl-[oxo-[2-(tribromomethylsulfonyl)phenyl]methyl]amino]acetic acid IUPAC Name: 2-[methyl-[2-(tribromomethylsulfonyl)benzoyl]amino]acetic acid Traditional Name: 2-[methyl-[2-(tribromomethylsulfonyl)benzoyl]amino]acetic acid Formula: C11H10Br3NO5S MolecularWeight: 507.9778

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)C1=CC=CC=C1S(=O)(=O)C(Br)(Br)Br

Isomeric SMILES

CN(CC(=O)O)C(=O)C1=CC=CC=C1S(=O)(=O)C(Br)(Br)Br

InChI

InChI=1S/C11H10Br3NO5S/c1-15(6-9(16)17)10(18)7-4-2-3-5-8(7)21(19,20)11(12,13)14/h2-5H,6H2,1H3,(H,16,17)