1-(3-nitrophenyl)-3-[2-[3-(3-nitrophenyl)-3-oxidanylidene-propyl]sulfanylethylsulfanyl]propan-1-one

Systemtic Name: 1-(3-nitrophenyl)-3-[2-[3-(3-nitrophenyl)-3-oxidanylidene-propyl]sulfanylethylsulfanyl]propan-1-one Openeye Name: 1-(3-nitrophenyl)-3-[2-[3-(3-nitrophenyl)-3-oxo-propyl]sulfanylethylsulfanyl]propan-1-one CAS Name: 1-(3-nitrophenyl)-3-[2-[[3-(3-nitrophenyl)-3-oxopropyl]thio]ethylthio]-1-propanone IUPAC Name: 1-(3-nitrophenyl)-3-[2-[3-(3-nitrophenyl)-3-oxopropyl]sulfanylethylsulfanyl]propan-1-one Traditional Name: 3-[2-[[3-keto-3-(3-nitrophenyl)propyl]thio]ethylthio]-1-(3-nitrophenyl)propan-1-one Formula: C20H20N2O6S2 MolecularWeight: 448.5126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O6S2/c23-19(15-3-1-5-17(13-15)21(25)26)7-9-29-11-12-30-10-8-20(24)16-4-2-6-18(14-16)22(27)28/h1-6,13-14H,7-12H2