1-[[2-[(2,4-dinitrophenyl)sulfanylmethyl]cyclohexen-1-yl]methylsulfanyl]-2,4-dinitro-benzene

Systemtic Name: 1-[[2-[(2,4-dinitrophenyl)sulfanylmethyl]cyclohexen-1-yl]methylsulfanyl]-2,4-dinitro-benzene Openeye Name: 1-[[2-[(2,4-dinitrophenyl)sulfanylmethyl]cyclohexen-1-yl]methylsulfanyl]-2,4-dinitro-benzene CAS Name: 1-[[2-[[(2,4-dinitrophenyl)thio]methyl]-1-cyclohexenyl]methylthio]-2,4-dinitrobenzene IUPAC Name: 1-[[2-[(2,4-dinitrophenyl)sulfanylmethyl]cyclohexen-1-yl]methylsulfanyl]-2,4-dinitrobenzene Traditional Name: 1-[[2-[[(2,4-dinitrophenyl)thio]methyl]cyclohexen-1-yl]methylthio]-2,4-dinitro-benzene Formula: C20H18N4O8S2 MolecularWeight: 506.50892

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=C(C1)CSC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])CSC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCC(=C(C1)CSC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])CSC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O8S2/c25-21(26)15-5-7-19(17(9-15)23(29)30)33-11-13-3-1-2-4-14(13)12-34-20-8-6-16(22(27)28)10-18(20)24(31)32/h5-10H,1-4,11-12H2