5-nitrobenzotriazol-2-ide; tetrabutylazanium

Systemtic Name: 5-nitrobenzotriazol-2-ide; tetrabutylazanium Openeye Name: 5-nitrobenzotriazol-2-ide; tetrabutylammonium CAS Name: 5-nitrobenzotriazol-2-ide; tetrabutylammonium IUPAC Name: 5-nitrobenzotriazol-2-ide; tetrabutylazanium Traditional Name: 5-nitrobenzotriazol-2-ide; tetrabutylammonium Formula: C22H39N5O2 MolecularWeight: 405.57736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC2=N[N-]N=C2C=C1[N+](=O)[O-]

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC2=N[N-]N=C2C=C1[N+](=O)[O-]

InChI

InChI=1S/C16H36N.C6H3N4O2/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;11-10(12)4-1-2-5-6(3-4)8-9-7-5/h5-16H2,1-4H3;1-3H/q+1;-1