3-methyl-5-[(5-nitro-1H-pyrrol-2-yl)carbonylamino]thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-5-[(5-nitro-1H-pyrrol-2-yl)carbonylamino]thiophene-2-carboxylic acid Openeye Name: 3-methyl-5-[(5-nitro-1H-pyrrole-2-carbonyl)amino]thiophene-2-carboxylic acid CAS Name: 3-methyl-5-[[(5-nitro-1H-pyrrol-2-yl)-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-methyl-5-[(5-nitro-1H-pyrrole-2-carbonyl)amino]thiophene-2-carboxylic acid Traditional Name: 3-methyl-5-[(5-nitro-1H-pyrrole-2-carbonyl)amino]-2-thenoic acid Formula: C11H9N3O5S MolecularWeight: 295.27126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C2=CC=C(N2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C2=CC=C(N2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H9N3O5S/c1-5-4-8(20-9(5)11(16)17)13-10(15)6-2-3-7(12-6)14(18)19/h2-4,12H,1H3,(H,13,15)(H,16,17)