methyl 3-nitrothiophene-2-carboxylate

Systemtic Name: methyl 3-nitrothiophene-2-carboxylate Openeye Name: methyl 3-nitrothiophene-2-carboxylate CAS Name: 3-nitro-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-nitrothiophene-2-carboxylate Traditional Name: 3-nitrothiophene-2-carboxylic acid methyl ester Formula: C6H5NO4S MolecularWeight: 187.1732

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C=CS1)[N+](=O)[O-]

InChI

InChI=1S/C6H5NO4S/c1-11-6(8)5-4(7(9)10)2-3-12-5/h2-3H,1H3