1-(2-dodecylsulfanyl-5-methyl-5-nitro-hexan-2-yl)sulfanyldodecane

Systemtic Name: 1-(2-dodecylsulfanyl-5-methyl-5-nitro-hexan-2-yl)sulfanyldodecane Openeye Name: 1-(1-dodecylsulfanyl-1,4-dimethyl-4-nitro-pentyl)sulfanyldodecane CAS Name: 1-[[2-(dodecylthio)-5-methyl-5-nitrohexan-2-yl]thio]dodecane IUPAC Name: 1-(2-dodecylsulfanyl-5-methyl-5-nitrohexan-2-yl)sulfanyldodecane Traditional Name: 1-[[1-(laurylthio)-1,4-dimethyl-4-nitro-pentyl]thio]dodecane Formula: C31H63NO2S2 MolecularWeight: 545.96742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(C)(CCC(C)(C)[N+](=O)[O-])SCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCSC(C)(CCC(C)(C)[N+](=O)[O-])SCCCCCCCCCCCC

InChI

InChI=1S/C31H63NO2S2/c1-6-8-10-12-14-16-18-20-22-24-28-35-31(5,27-26-30(3,4)32(33)34)36-29-25-23-21-19-17-15-13-11-9-7-2/h6-29H2,1-5H3