2-[[4,5-bis(bromanyl)-1-methyl-pyrrol-2-yl]carbonylamino]ethanesulfonic acid

Systemtic Name: 2-[[4,5-bis(bromanyl)-1-methyl-pyrrol-2-yl]carbonylamino]ethanesulfonic acid Openeye Name: 2-[(4,5-dibromo-1-methyl-pyrrole-2-carbonyl)amino]ethanesulfonic acid CAS Name: 2-[[(4,5-dibromo-1-methyl-2-pyrrolyl)-oxomethyl]amino]ethanesulfonic acid IUPAC Name: 2-[(4,5-dibromo-1-methylpyrrole-2-carbonyl)amino]ethanesulfonic acid Traditional Name: 2-[(4,5-dibromo-1-methyl-pyrrole-2-carbonyl)amino]ethanesulfonic acid Formula: C8H10Br2N2O4S MolecularWeight: 390.049

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=C1Br)Br)C(=O)NCCS(=O)(=O)O

Isomeric SMILES

CN1C(=CC(=C1Br)Br)C(=O)NCCS(=O)(=O)O

InChI

InChI=1S/C8H10Br2N2O4S/c1-12-6(4-5(9)7(12)10)8(13)11-2-3-17(14,15)16/h4H,2-3H2,1H3,(H,11,13)(H,14,15,16)