2-tert-butyl-5,5-dimethyl-2-[5-(nitromethylsulfanyl)thiophen-2-yl]-1,3-dioxane

Systemtic Name: 2-tert-butyl-5,5-dimethyl-2-[5-(nitromethylsulfanyl)thiophen-2-yl]-1,3-dioxane Openeye Name: 2-tert-butyl-5,5-dimethyl-2-[5-(nitromethylsulfanyl)-2-thienyl]-1,3-dioxane CAS Name: 2-tert-butyl-5,5-dimethyl-2-[5-(nitromethylthio)-2-thiophenyl]-1,3-dioxane IUPAC Name: 2-tert-butyl-5,5-dimethyl-2-[5-(nitromethylsulfanyl)thiophen-2-yl]-1,3-dioxane Traditional Name: 2-tert-butyl-5,5-dimethyl-2-[5-(nitromethylthio)-2-thienyl]-1,3-dioxane Formula: C15H23NO4S2 MolecularWeight: 345.47742

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)(C2=CC=C(S2)SC[N+](=O)[O-])C(C)(C)C)C

Isomeric SMILES

CC1(COC(OC1)(C2=CC=C(S2)SC[N+](=O)[O-])C(C)(C)C)C

InChI

InChI=1S/C15H23NO4S2/c1-13(2,3)15(19-8-14(4,5)9-20-15)11-6-7-12(22-11)21-10-16(17)18/h6-7H,8-10H2,1-5H3