5-[3-(methylamino)-3-oxidanylidene-propyl]furan-2-sulfonic acid

Systemtic Name: 5-[3-(methylamino)-3-oxidanylidene-propyl]furan-2-sulfonic acid Openeye Name: 5-[3-(methylamino)-3-oxo-propyl]furan-2-sulfonic acid CAS Name: 5-[3-(methylamino)-3-oxopropyl]-2-furansulfonic acid IUPAC Name: 5-[3-(methylamino)-3-oxopropyl]furan-2-sulfonic acid Traditional Name: 5-[3-keto-3-(methylamino)propyl]furan-2-sulfonic acid Formula: C8H11NO5S MolecularWeight: 233.24164

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CCC1=CC=C(O1)S(=O)(=O)O

Isomeric SMILES

CNC(=O)CCC1=CC=C(O1)S(=O)(=O)O

InChI

InChI=1S/C8H11NO5S/c1-9-7(10)4-2-6-3-5-8(14-6)15(11,12)13/h3,5H,2,4H2,1H3,(H,9,10)(H,11,12,13)