1-[2-[2-(2,4-dinitrophenyl)sulfanylethoxy]ethylsulfanyl]-2,4-dinitro-benzene

Systemtic Name: 1-[2-[2-(2,4-dinitrophenyl)sulfanylethoxy]ethylsulfanyl]-2,4-dinitro-benzene Openeye Name: 1-[2-[2-(2,4-dinitrophenyl)sulfanylethoxy]ethylsulfanyl]-2,4-dinitro-benzene CAS Name: 1-[2-[2-[(2,4-dinitrophenyl)thio]ethoxy]ethylthio]-2,4-dinitrobenzene IUPAC Name: 1-[2-[2-(2,4-dinitrophenyl)sulfanylethoxy]ethylsulfanyl]-2,4-dinitrobenzene Traditional Name: 1-[2-[2-[(2,4-dinitrophenyl)thio]ethoxy]ethylthio]-2,4-dinitro-benzene Formula: C16H14N4O9S2 MolecularWeight: 470.43376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SCCOCCSC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SCCOCCSC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O9S2/c21-17(22)11-1-3-15(13(9-11)19(25)26)30-7-5-29-6-8-31-16-4-2-12(18(23)24)10-14(16)20(27)28/h1-4,9-10H,5-8H2