bis(benzotriazol-1-ylmethyl)-[2-[methyl(phenyl)amino]ethyl]azanium

Systemtic Name: bis(benzotriazol-1-ylmethyl)-[2-[methyl(phenyl)amino]ethyl]azanium Openeye Name: bis(benzotriazol-1-ylmethyl)-[2-(N-methylanilino)ethyl]ammonium CAS Name: bis(1-benzotriazolylmethyl)-[2-(N-methylanilino)ethyl]ammonium IUPAC Name: bis(benzotriazol-1-ylmethyl)-[2-(N-methylanilino)ethyl]azanium Traditional Name: bis(benzotriazol-1-ylmethyl)-[2-(N-methylanilino)ethyl]ammonium Formula: C23H25N8+ MolecularWeight: 413.4982

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC[NH+](CN1C2=CC=CC=C2N=N1)CN3C4=CC=CC=C4N=N3)C5=CC=CC=C5

Isomeric SMILES

CN(CC[NH+](CN1C2=CC=CC=C2N=N1)CN3C4=CC=CC=C4N=N3)C5=CC=CC=C5

InChI

InChI=1S/C23H24N8/c1-28(19-9-3-2-4-10-19)15-16-29(17-30-22-13-7-5-11-20(22)24-26-30)18-31-23-14-8-6-12-21(23)25-27-31/h2-14H,15-18H2,1H3/p+1