2,2-dimethyl-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane

Systemtic Name: 2,2-dimethyl-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane Openeye Name: 2,2-dimethyl-5-[(5-nitro-2-thienyl)methylene]-1,3-dioxane CAS Name: 2,2-dimethyl-5-[(5-nitro-2-thiophenyl)methylidene]-1,3-dioxane IUPAC Name: 2,2-dimethyl-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-dioxane Traditional Name: 2,2-dimethyl-5-[(5-nitro-2-thienyl)methylene]-1,3-dioxane Formula: C11H13NO4S MolecularWeight: 255.29022

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(=CC2=CC=C(S2)[N+](=O)[O-])CO1)C

Isomeric SMILES

CC1(OCC(=CC2=CC=C(S2)[N+](=O)[O-])CO1)C

InChI

InChI=1S/C11H13NO4S/c1-11(2)15-6-8(7-16-11)5-9-3-4-10(17-9)12(13)14/h3-5H,6-7H2,1-2H3