4-(2-methylpropylcarbamoyl)furan-2-sulfonic acid

Systemtic Name: 4-(2-methylpropylcarbamoyl)furan-2-sulfonic acid Openeye Name: 4-(isobutylcarbamoyl)furan-2-sulfonic acid CAS Name: 4-[(2-methylpropylamino)-oxomethyl]-2-furansulfonic acid IUPAC Name: 4-(2-methylpropylcarbamoyl)furan-2-sulfonic acid Traditional Name: 4-(isobutylcarbamoyl)furan-2-sulfonic acid Formula: C9H13NO5S MolecularWeight: 247.26822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=COC(=C1)S(=O)(=O)O

Isomeric SMILES

CC(C)CNC(=O)C1=COC(=C1)S(=O)(=O)O

InChI

InChI=1S/C9H13NO5S/c1-6(2)4-10-9(11)7-3-8(15-5-7)16(12,13)14/h3,5-6H,4H2,1-2H3,(H,10,11)(H,12,13,14)