1-hexylsulfanyl-2,4-dinitro-benzene

Systemtic Name: 1-hexylsulfanyl-2,4-dinitro-benzene Openeye Name: 1-hexylsulfanyl-2,4-dinitro-benzene CAS Name: 1-(hexylthio)-2,4-dinitrobenzene IUPAC Name: 1-hexylsulfanyl-2,4-dinitrobenzene Traditional Name: 1-(hexylthio)-2,4-dinitro-benzene Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCCSC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O4S/c1-2-3-4-5-8-19-12-7-6-10(13(15)16)9-11(12)14(17)18/h6-7,9H,2-5,8H2,1H3