1-[4-[2-[2-(4-ethanoyl-2-nitro-phenyl)sulfanylethoxy]ethylsulfanyl]-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-[2-[2-(4-ethanoyl-2-nitro-phenyl)sulfanylethoxy]ethylsulfanyl]-3-nitro-phenyl]ethanone Openeye Name: 1-[4-[2-[2-(4-acetyl-2-nitro-phenyl)sulfanylethoxy]ethylsulfanyl]-3-nitro-phenyl]ethanone CAS Name: 1-[4-[2-[2-[(4-acetyl-2-nitrophenyl)thio]ethoxy]ethylthio]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-[2-[2-(4-acetyl-2-nitrophenyl)sulfanylethoxy]ethylsulfanyl]-3-nitrophenyl]ethanone Traditional Name: 1-[4-[2-[2-[(4-acetyl-2-nitro-phenyl)thio]ethoxy]ethylthio]-3-nitro-phenyl]ethanone Formula: C20H20N2O7S2 MolecularWeight: 464.512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O7S2/c1-13(23)15-3-5-19(17(11-15)21(25)26)30-9-7-29-8-10-31-20-6-4-16(14(2)24)12-18(20)22(27)28/h3-6,11-12H,7-10H2,1-2H3