2-[(4-bromophenyl)sulfonylamino]-4-methylsulfonyl-butanoic acid

Systemtic Name: 2-[(4-bromophenyl)sulfonylamino]-4-methylsulfonyl-butanoic acid Openeye Name: 2-[(4-bromophenyl)sulfonylamino]-4-methylsulfonyl-butanoic acid CAS Name: 2-[(4-bromophenyl)sulfonylamino]-4-methylsulfonylbutanoic acid IUPAC Name: 2-[(4-bromophenyl)sulfonylamino]-4-methylsulfonylbutanoic acid Traditional Name: 2-(brosylamino)-4-mesyl-butyric acid Formula: C11H14BrNO6S2 MolecularWeight: 400.26596

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C11H14BrNO6S2/c1-20(16,17)7-6-10(11(14)15)13-21(18,19)9-4-2-8(12)3-5-9/h2-5,10,13H,6-7H2,1H3,(H,14,15)