N-(5-bromanyl-3,4-dinitro-thiophen-2-yl)-N',N'-dimethyl-propane-1,3-diamine

Systemtic Name: N-(5-bromanyl-3,4-dinitro-thiophen-2-yl)-N',N'-dimethyl-propane-1,3-diamine Openeye Name: N-(5-bromo-3,4-dinitro-2-thienyl)-N',N'-dimethyl-propane-1,3-diamine CAS Name: N-(5-bromo-3,4-dinitro-2-thiophenyl)-N',N'-dimethylpropane-1,3-diamine IUPAC Name: N-(5-bromo-3,4-dinitrothiophen-2-yl)-N',N'-dimethylpropane-1,3-diamine Traditional Name: 3-[(5-bromo-3,4-dinitro-2-thienyl)amino]propyl-dimethyl-amine Formula: C9H13BrN4O4S MolecularWeight: 353.19292

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC1=C(C(=C(S1)Br)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(C)CCCNC1=C(C(=C(S1)Br)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H13BrN4O4S/c1-12(2)5-3-4-11-9-7(14(17)18)6(13(15)16)8(10)19-9/h11H,3-5H2,1-2H3