2-[6-(2-methanoyl-4-nitro-phenyl)sulfanylhexylsulfanyl]-5-nitro-benzaldehyde

Systemtic Name: 2-[6-(2-methanoyl-4-nitro-phenyl)sulfanylhexylsulfanyl]-5-nitro-benzaldehyde Openeye Name: 2-[6-(2-formyl-4-nitro-phenyl)sulfanylhexylsulfanyl]-5-nitro-benzaldehyde CAS Name: 2-[6-[(2-formyl-4-nitrophenyl)thio]hexylthio]-5-nitrobenzaldehyde IUPAC Name: 2-[6-(2-formyl-4-nitrophenyl)sulfanylhexylsulfanyl]-5-nitrobenzaldehyde Traditional Name: 2-[6-[(2-formyl-4-nitro-phenyl)thio]hexylthio]-5-nitro-benzaldehyde Formula: C20H20N2O6S2 MolecularWeight: 448.5126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C=O)SCCCCCCSC2=C(C=C(C=C2)[N+](=O)[O-])C=O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C=O)SCCCCCCSC2=C(C=C(C=C2)[N+](=O)[O-])C=O

InChI

InChI=1S/C20H20N2O6S2/c23-13-15-11-17(21(25)26)5-7-19(15)29-9-3-1-2-4-10-30-20-8-6-18(22(27)28)12-16(20)14-24/h5-8,11-14H,1-4,9-10H2