2,4-dinitro-1-(4-nitrophenyl)sulfanyl-benzene

Systemtic Name: 2,4-dinitro-1-(4-nitrophenyl)sulfanyl-benzene Openeye Name: 2,4-dinitro-1-(4-nitrophenyl)sulfanyl-benzene CAS Name: 2,4-dinitro-1-[(4-nitrophenyl)thio]benzene IUPAC Name: 2,4-dinitro-1-(4-nitrophenyl)sulfanylbenzene Traditional Name: 2,4-dinitro-1-[(4-nitrophenyl)thio]benzene Formula: C12H7N3O6S MolecularWeight: 321.26548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H7N3O6S/c16-13(17)8-1-4-10(5-2-8)22-12-6-3-9(14(18)19)7-11(12)15(20)21/h1-7H