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3-[[2-cyano-3-[3-(dimethylazaniumyl)propylamino]-4-nitro-phenyl]amino]propyl-dimethyl-azanium

3-[[2-cyano-3-[3-(dimethylazaniumyl)propylamino]-4-nitro-phenyl]amino]propyl-dimethyl-azanium

Systemtic Name:3-[[2-cyano-3-[3-(dimethylazaniumyl)propylamino]-4-nitro-phenyl]amino]propyl-dimethyl-azanium
Openeye Name:3-[2-cyano-3-[3-(dimethylammonio)propylamino]-4-nitro-anilino]propyl-dimethyl-ammonium
CAS Name:3-[2-cyano-3-[3-(dimethylammonio)propylamino]-4-nitroanilino]propyl-dimethylammonium
IUPAC Name:3-[2-cyano-3-[3-(dimethylazaniumyl)propylamino]-4-nitroanilino]propyl-dimethylazanium
Traditional Name:3-[2-cyano-3-[3-(dimethylammonio)propylamino]-4-nitro-anilino]propyl-dimethyl-ammonium
Formula: C17H30N6O2+2
MolecularWeight: 350.4591
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=C(C(=C(C=C1)[N+](=O)[O-])NCCC[NH+](C)C)C#N


Isomeric SMILES

C[NH+](C)CCCNC1=C(C(=C(C=C1)[N+](=O)[O-])NCCC[NH+](C)C)C#N


InChI

InChI=1S/C17H28N6O2/c1-21(2)11-5-9-19-15-7-8-16(23(24)25)17(14(15)13-18)20-10-6-12-22(3)4/h7-8,19-20H,5-6,9-12H2,1-4H3/p+2


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