8-[2-(5,7-dinitroquinolin-8-yl)sulfanylethylsulfanyl]-5,7-dinitro-quinoline

Systemtic Name: 8-[2-(5,7-dinitroquinolin-8-yl)sulfanylethylsulfanyl]-5,7-dinitro-quinoline Openeye Name: 8-[2-[(5,7-dinitro-8-quinolyl)sulfanyl]ethylsulfanyl]-5,7-dinitro-quinoline CAS Name: 8-[2-[(5,7-dinitro-8-quinolinyl)thio]ethylthio]-5,7-dinitroquinoline IUPAC Name: 8-[2-(5,7-dinitroquinolin-8-yl)sulfanylethylsulfanyl]-5,7-dinitroquinoline Traditional Name: 8-[2-[(5,7-dinitro-8-quinolyl)thio]ethylthio]-5,7-dinitro-quinoline Formula: C20H12N6O8S2 MolecularWeight: 528.47468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])SCCSC3=C(C=C(C4=C3N=CC=C4)[N+](=O)[O-])[N+](=O)[O-])N=C1

Isomeric SMILES

C1=CC2=C(C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])SCCSC3=C(C=C(C4=C3N=CC=C4)[N+](=O)[O-])[N+](=O)[O-])N=C1

InChI

InChI=1S/C20H12N6O8S2/c27-23(28)13-9-15(25(31)32)19(17-11(13)3-1-5-21-17)35-7-8-36-20-16(26(33)34)10-14(24(29)30)12-4-2-6-22-18(12)20/h1-6,9-10H,7-8H2