2,3,5-triphenyl-1-(3,5,5-trimethylhexyl)-2H-1,2,3,4-tetrazol-2-ium

Systemtic Name: 2,3,5-triphenyl-1-(3,5,5-trimethylhexyl)-2H-1,2,3,4-tetrazol-2-ium Openeye Name: 2,3,5-triphenyl-1-(3,5,5-trimethylhexyl)-2H-tetrazol-2-ium CAS Name: 2,3,5-triphenyl-1-(3,5,5-trimethylhexyl)-2H-tetrazol-2-ium IUPAC Name: 2,3,5-triphenyl-1-(3,5,5-trimethylhexyl)-2H-tetrazol-2-ium Traditional Name: 2,3,5-triphenyl-1-(3,5,5-trimethylhexyl)-2H-tetrazol-2-ium Formula: C28H35N4+ MolecularWeight: 427.6043

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1C(=NN([NH+]1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)CC(C)(C)C

Isomeric SMILES

CC(CCN1C(=NN([NH+]1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)CC(C)(C)C

InChI

InChI=1S/C28H34N4/c1-23(22-28(2,3)4)20-21-30-27(24-14-8-5-9-15-24)29-31(25-16-10-6-11-17-25)32(30)26-18-12-7-13-19-26/h5-19,23H,20-22H2,1-4H3/p+1