benzotriazol-1-ylmethyl-[[benzotriazol-1-ylmethyl-(phenylmethyl)amino]methyl]-(phenylmethyl)azanium

Systemtic Name: benzotriazol-1-ylmethyl-[[benzotriazol-1-ylmethyl-(phenylmethyl)amino]methyl]-(phenylmethyl)azanium Openeye Name: benzotriazol-1-ylmethyl-[[benzotriazol-1-ylmethyl(benzyl)amino]methyl]-benzyl-ammonium CAS Name: 1-benzotriazolylmethyl-[[1-benzotriazolylmethyl-(phenylmethyl)amino]methyl]-(phenylmethyl)ammonium IUPAC Name: benzotriazol-1-ylmethyl-[[benzotriazol-1-ylmethyl(benzyl)amino]methyl]-benzylazanium Traditional Name: benzotriazol-1-ylmethyl-[[benzotriazol-1-ylmethyl(benzyl)amino]methyl]-benzyl-ammonium Formula: C29H29N8+ MolecularWeight: 489.59416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH+](CN2C3=CC=CC=C3N=N2)CN(CC4=CC=CC=C4)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

C1=CC=C(C=C1)C[NH+](CN2C3=CC=CC=C3N=N2)CN(CC4=CC=CC=C4)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C29H28N8/c1-3-11-24(12-4-1)19-34(22-36-28-17-9-7-15-26(28)30-32-36)21-35(20-25-13-5-2-6-14-25)23-37-29-18-10-8-16-27(29)31-33-37/h1-18H,19-23H2/p+1