[3-nitro-4-[2-[2-nitro-4-(phenylcarbonyl)phenyl]sulfanylethylsulfanyl]phenyl]-phenyl-methanone

Systemtic Name: [3-nitro-4-[2-[2-nitro-4-(phenylcarbonyl)phenyl]sulfanylethylsulfanyl]phenyl]-phenyl-methanone Openeye Name: [4-[2-(4-benzoyl-2-nitro-phenyl)sulfanylethylsulfanyl]-3-nitro-phenyl]-phenyl-methanone CAS Name: [4-[2-[(4-benzoyl-2-nitrophenyl)thio]ethylthio]-3-nitrophenyl]-phenylmethanone IUPAC Name: [4-[2-(4-benzoyl-2-nitrophenyl)sulfanylethylsulfanyl]-3-nitrophenyl]-phenylmethanone Traditional Name: [4-[2-[(4-benzoyl-2-nitro-phenyl)thio]ethylthio]-3-nitro-phenyl]-phenyl-methanone Formula: C28H20N2O6S2 MolecularWeight: 544.5982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)SCCSC3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)SCCSC3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C28H20N2O6S2/c31-27(19-7-3-1-4-8-19)21-11-13-25(23(17-21)29(33)34)37-15-16-38-26-14-12-22(18-24(26)30(35)36)28(32)20-9-5-2-6-10-20/h1-14,17-18H,15-16H2