[4-(1,4-diazepan-1-yl)phenyl]-(1,3-dimethylimidazol-1-ium-2-yl)diazene

Systemtic Name: [4-(1,4-diazepan-1-yl)phenyl]-(1,3-dimethylimidazol-1-ium-2-yl)diazene Openeye Name: [4-(1,4-diazepan-1-yl)phenyl]-(1,3-dimethylimidazol-1-ium-2-yl)diazene CAS Name: [4-(1,4-diazepan-1-yl)phenyl]-(1,3-dimethyl-2-imidazol-1-iumyl)diazene IUPAC Name: [4-(1,4-diazepan-1-yl)phenyl]-(1,3-dimethylimidazol-1-ium-2-yl)diazene Traditional Name: [4-(1,4-diazepan-1-yl)phenyl]-(1,3-dimethylimidazol-1-ium-2-yl)diazene Formula: C16H23N6+ MolecularWeight: 299.39402

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C[N+](=C1N=NC2=CC=C(C=C2)N3CCCNCC3)C

Isomeric SMILES

CN1C=C[N+](=C1N=NC2=CC=C(C=C2)N3CCCNCC3)C

InChI

InChI=1S/C16H23N6/c1-20-12-13-21(2)16(20)19-18-14-4-6-15(7-5-14)22-10-3-8-17-9-11-22/h4-7,12-13,17H,3,8-11H2,1-2H3/q+1