5-[[furan-2-ylmethyl(methylsulfonyl)amino]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[furan-2-ylmethyl(methylsulfonyl)amino]methyl]furan-2-carboxylic acid Openeye Name: 5-[[2-furylmethyl(methylsulfonyl)amino]methyl]furan-2-carboxylic acid CAS Name: 5-[[2-furanylmethyl(methylsulfonyl)amino]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[furan-2-ylmethyl(methylsulfonyl)amino]methyl]furan-2-carboxylic acid Traditional Name: 5-[[2-furfuryl(mesyl)amino]methyl]-2-furoic acid Formula: C12H13NO6S MolecularWeight: 299.29972

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=CO1)CC2=CC=C(O2)C(=O)O

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=CO1)CC2=CC=C(O2)C(=O)O

InChI

InChI=1S/C12H13NO6S/c1-20(16,17)13(7-9-3-2-6-18-9)8-10-4-5-11(19-10)12(14)15/h2-6H,7-8H2,1H3,(H,14,15)