1-(3,5-dinitrophenyl)sulfanyl-2,4-dinitro-benzene

Systemtic Name: 1-(3,5-dinitrophenyl)sulfanyl-2,4-dinitro-benzene Openeye Name: 1-(3,5-dinitrophenyl)sulfanyl-2,4-dinitro-benzene CAS Name: 1-[(3,5-dinitrophenyl)thio]-2,4-dinitrobenzene IUPAC Name: 1-(3,5-dinitrophenyl)sulfanyl-2,4-dinitrobenzene Traditional Name: 1-[(3,5-dinitrophenyl)thio]-2,4-dinitro-benzene Formula: C12H6N4O8S MolecularWeight: 366.26304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SC2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SC2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H6N4O8S/c17-13(18)7-1-2-12(11(6-7)16(23)24)25-10-4-8(14(19)20)3-9(5-10)15(21)22/h1-6H