[(S)-benzotriazol-1-yl(phenyl)methyl]-bis(phenylmethyl)azanium

Systemtic Name: [(S)-benzotriazol-1-yl(phenyl)methyl]-bis(phenylmethyl)azanium Openeye Name: [(S)-benzotriazol-1-yl(phenyl)methyl]-dibenzyl-ammonium CAS Name: [(S)-1-benzotriazolyl(phenyl)methyl]-bis(phenylmethyl)ammonium IUPAC Name: [(S)-benzotriazol-1-yl(phenyl)methyl]-dibenzylazanium Traditional Name: [(S)-benzotriazol-1-yl(phenyl)methyl]-dibenzyl-ammonium Formula: C27H25N4+ MolecularWeight: 405.5142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH+](CC2=CC=CC=C2)C(C3=CC=CC=C3)N4C5=CC=CC=C5N=N4

Isomeric SMILES

C1=CC=C(C=C1)C[NH+](CC2=CC=CC=C2)[C@H](C3=CC=CC=C3)N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C27H24N4/c1-4-12-22(13-5-1)20-30(21-23-14-6-2-7-15-23)27(24-16-8-3-9-17-24)31-26-19-11-10-18-25(26)28-29-31/h1-19,27H,20-21H2/p+1/t27-/m0/s1