methyl 5-[(E)-2-(5-chloranylthiophen-2-yl)ethenyl]-4-nitro-thiophene-2-carboxylate

Systemtic Name: methyl 5-[(E)-2-(5-chloranylthiophen-2-yl)ethenyl]-4-nitro-thiophene-2-carboxylate Openeye Name: methyl 5-[(E)-2-(5-chloro-2-thienyl)vinyl]-4-nitro-thiophene-2-carboxylate CAS Name: 5-[(E)-2-(5-chloro-2-thiophenyl)ethenyl]-4-nitro-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(E)-2-(5-chlorothiophen-2-yl)ethenyl]-4-nitrothiophene-2-carboxylate Traditional Name: 5-[(E)-2-(5-chloro-2-thienyl)vinyl]-4-nitro-thiophene-2-carboxylic acid methyl ester Formula: C12H8ClNO4S2 MolecularWeight: 329.77922

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)C=CC2=CC=C(S2)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(S1)/C=C/C2=CC=C(S2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H8ClNO4S2/c1-18-12(15)10-6-8(14(16)17)9(20-10)4-2-7-3-5-11(13)19-7/h2-6H,1H3/b4-2+