5-methyl-4-nitro-thiophene-2-carboxylic acid

Systemtic Name: 5-methyl-4-nitro-thiophene-2-carboxylic acid Openeye Name: 5-methyl-4-nitro-thiophene-2-carboxylic acid CAS Name: 5-methyl-4-nitro-2-thiophenecarboxylic acid IUPAC Name: 5-methyl-4-nitrothiophene-2-carboxylic acid Traditional Name: 5-methyl-4-nitro-2-thenoic acid Formula: C6H5NO4S MolecularWeight: 187.1732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(S1)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C6H5NO4S/c1-3-4(7(10)11)2-5(12-3)6(8)9/h2H,1H3,(H,8,9)