methyl 4-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-5-nitro-thiophene-3-carboxylate

Systemtic Name: methyl 4-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-5-nitro-thiophene-3-carboxylate Openeye Name: methyl 4-(2-methoxy-2-oxo-ethyl)sulfanyl-5-nitro-thiophene-3-carboxylate CAS Name: 4-[(2-methoxy-2-oxoethyl)thio]-5-nitro-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(2-methoxy-2-oxoethyl)sulfanyl-5-nitrothiophene-3-carboxylate Traditional Name: 4-[(2-keto-2-methoxy-ethyl)thio]-5-nitro-thiophene-3-carboxylic acid methyl ester Formula: C9H9NO6S2 MolecularWeight: 291.30086

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=C(SC=C1C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CSC1=C(SC=C1C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C9H9NO6S2/c1-15-6(11)4-17-7-5(9(12)16-2)3-18-8(7)10(13)14/h3H,4H2,1-2H3