methyl 2-[3-[(E)-2-nitroethenyl]thiophen-2-yl]sulfonylethanoate

Systemtic Name: methyl 2-[3-[(E)-2-nitroethenyl]thiophen-2-yl]sulfonylethanoate Openeye Name: methyl 2-[[3-[(E)-2-nitrovinyl]-2-thienyl]sulfonyl]acetate CAS Name: 2-[[3-[(E)-2-nitroethenyl]-2-thiophenyl]sulfonyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[(E)-2-nitroethenyl]thiophen-2-yl]sulfonylacetate Traditional Name: 2-[[3-[(E)-2-nitrovinyl]-2-thienyl]sulfonyl]acetic acid methyl ester Formula: C9H9NO6S2 MolecularWeight: 291.30086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO6S2/c1-16-8(11)6-18(14,15)9-7(3-5-17-9)2-4-10(12)13/h2-5H,6H2,1H3/b4-2+