[4-[2-isocyano-1-(2-isocyanoethyl)aziridin-1-ium-1-yl]-2-propyl-phenyl]diazene

Systemtic Name: [4-[2-isocyano-1-(2-isocyanoethyl)aziridin-1-ium-1-yl]-2-propyl-phenyl]diazene Openeye Name: [4-[2-isocyano-1-(2-isocyanoethyl)aziridin-1-ium-1-yl]-2-propyl-phenyl]diazene CAS Name: [4-[2-isocyano-1-(2-isocyanoethyl)-1-aziridin-1-iumyl]-2-propylphenyl]diazene IUPAC Name: [4-[2-isocyano-1-(2-isocyanoethyl)aziridin-1-ium-1-yl]-2-propylphenyl]diazene Traditional Name: [4-[2-isocyano-1-(2-isocyanoethyl)ethylenimin-1-ium-1-yl]-2-propyl-phenyl]diazene Formula: C15H18N5+ MolecularWeight: 268.33692

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)[N+]2(CC2[N+]#[C-])CC[N+]#[C-])N=N

Isomeric SMILES

CCCC1=C(C=CC(=C1)[N+]2(CC2[N+]#[C-])CC[N+]#[C-])N=N

InChI

InChI=1S/C15H18N5/c1-4-5-12-10-13(6-7-14(12)19-16)20(9-8-17-2)11-15(20)18-3/h6-7,10,15-16H,4-5,8-9,11H2,1H3/q+1