tris(benzotriazol-1-ylmethyl)azanium

Systemtic Name: tris(benzotriazol-1-ylmethyl)azanium Openeye Name: tris(benzotriazol-1-ylmethyl)ammonium CAS Name: tris(1-benzotriazolylmethyl)ammonium IUPAC Name: tris(benzotriazol-1-ylmethyl)azanium Traditional Name: tris(benzotriazol-1-ylmethyl)ammonium Formula: C21H19N10+ MolecularWeight: 411.44256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C[NH+](CN3C4=CC=CC=C4N=N3)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C[NH+](CN3C4=CC=CC=C4N=N3)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C21H18N10/c1-4-10-19-16(7-1)22-25-29(19)13-28(14-30-20-11-5-2-8-17(20)23-26-30)15-31-21-12-6-3-9-18(21)24-27-31/h1-12H,13-15H2/p+1