1-[2,5-bis(oxidanyl)-1H-pyrrol-3-yl]propane-2-sulfonic acid

Systemtic Name: 1-[2,5-bis(oxidanyl)-1H-pyrrol-3-yl]propane-2-sulfonic acid Openeye Name: 1-(2,5-dihydroxy-1H-pyrrol-3-yl)propane-2-sulfonic acid CAS Name: 1-(2,5-dihydroxy-1H-pyrrol-3-yl)-2-propanesulfonic acid IUPAC Name: 1-(2,5-dihydroxy-1H-pyrrol-3-yl)propane-2-sulfonic acid Traditional Name: 1-(2,5-dihydroxy-1H-pyrrol-3-yl)propane-2-sulfonic acid Formula: C7H11NO5S MolecularWeight: 221.23094

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(NC(=C1)O)O)S(=O)(=O)O

Isomeric SMILES

CC(CC1=C(NC(=C1)O)O)S(=O)(=O)O

InChI

InChI=1S/C7H11NO5S/c1-4(14(11,12)13)2-5-3-6(9)8-7(5)10/h3-4,8-10H,2H2,1H3,(H,11,12,13)