2-[[4-[(1,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]phenyl]-ethyl-amino]ethyl-trimethyl-azanium

Systemtic Name: 2-[[4-[(1,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]phenyl]-ethyl-amino]ethyl-trimethyl-azanium Openeye Name: 2-[4-[(1,4-dimethyl-1,2,4-triazol-4-ium-3-yl)azo]-N-ethyl-anilino]ethyl-trimethyl-ammonium CAS Name: 2-[4-[(1,4-dimethyl-1,2,4-triazol-4-ium-3-yl)azo]-N-ethylanilino]ethyl-trimethylammonium IUPAC Name: 2-[4-[(1,4-dimethyl-1,2,4-triazol-4-ium-3-yl)diazenyl]-N-ethylanilino]ethyl-trimethylazanium Traditional Name: 2-[4-[(1,4-dimethyl-1,2,4-triazol-4-ium-3-yl)azo]-N-ethyl-anilino]ethyl-trimethyl-ammonium Formula: C17H29N7+2 MolecularWeight: 331.45906

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2=NN(C=[N+]2C)C

Isomeric SMILES

CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2=NN(C=[N+]2C)C

InChI

InChI=1S/C17H29N7/c1-7-23(12-13-24(4,5)6)16-10-8-15(9-11-16)18-19-17-20-22(3)14-21(17)2/h8-11,14H,7,12-13H2,1-6H3/q+2