2-[5-(nitromethylsulfonyl)thiophen-2-yl]-1,3-dioxane

Systemtic Name: 2-[5-(nitromethylsulfonyl)thiophen-2-yl]-1,3-dioxane Openeye Name: 2-[5-(nitromethylsulfonyl)-2-thienyl]-1,3-dioxane CAS Name: 2-[5-(nitromethylsulfonyl)-2-thiophenyl]-1,3-dioxane IUPAC Name: 2-[5-(nitromethylsulfonyl)thiophen-2-yl]-1,3-dioxane Traditional Name: 2-[5-(nitromethylsulfonyl)-2-thienyl]-1,3-dioxane Formula: C9H11NO6S2 MolecularWeight: 293.31674

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(OC1)C2=CC=C(S2)S(=O)(=O)C[N+](=O)[O-]

Isomeric SMILES

C1COC(OC1)C2=CC=C(S2)S(=O)(=O)C[N+](=O)[O-]

InChI

InChI=1S/C9H11NO6S2/c11-10(12)6-18(13,14)8-3-2-7(17-8)9-15-4-1-5-16-9/h2-3,9H,1,4-6H2