3-methyl-5-[(5-nitrofuran-2-yl)carbonylamino]thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-5-[(5-nitrofuran-2-yl)carbonylamino]thiophene-2-carboxylic acid Openeye Name: 3-methyl-5-[(5-nitrofuran-2-carbonyl)amino]thiophene-2-carboxylic acid CAS Name: 3-methyl-5-[[(5-nitro-2-furanyl)-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-methyl-5-[(5-nitrofuran-2-carbonyl)amino]thiophene-2-carboxylic acid Traditional Name: 3-methyl-5-[(5-nitro-2-furoyl)amino]-2-thenoic acid Formula: C11H8N2O6S MolecularWeight: 296.25602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H8N2O6S/c1-5-4-7(20-9(5)11(15)16)12-10(14)6-2-3-8(19-6)13(17)18/h2-4H,1H3,(H,12,14)(H,15,16)