1-dodecylsulfanyl-2,4-dinitro-benzene

Systemtic Name: 1-dodecylsulfanyl-2,4-dinitro-benzene Openeye Name: 1-dodecylsulfanyl-2,4-dinitro-benzene CAS Name: 1-(dodecylthio)-2,4-dinitrobenzene IUPAC Name: 1-dodecylsulfanyl-2,4-dinitrobenzene Traditional Name: 1-(laurylthio)-2,4-dinitro-benzene Formula: C18H28N2O4S MolecularWeight: 368.49092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCSC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H28N2O4S/c1-2-3-4-5-6-7-8-9-10-11-14-25-18-13-12-16(19(21)22)15-17(18)20(23)24/h12-13,15H,2-11,14H2,1H3