[(1R)-1,2-bis(benzotriazol-1-yl)ethyl]-bis(phenylmethyl)azanium

Systemtic Name: [(1R)-1,2-bis(benzotriazol-1-yl)ethyl]-bis(phenylmethyl)azanium Openeye Name: dibenzyl-[(1R)-1,2-bis(benzotriazol-1-yl)ethyl]ammonium CAS Name: [(1R)-1,2-bis(1-benzotriazolyl)ethyl]-bis(phenylmethyl)ammonium IUPAC Name: dibenzyl-[(1R)-1,2-bis(benzotriazol-1-yl)ethyl]azanium Traditional Name: dibenzyl-[(1R)-1,2-bis(benzotriazol-1-yl)ethyl]ammonium Formula: C28H26N7+ MolecularWeight: 460.55294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH+](CC2=CC=CC=C2)C(CN3C4=CC=CC=C4N=N3)N5C6=CC=CC=C6N=N5

Isomeric SMILES

C1=CC=C(C=C1)C[NH+](CC2=CC=CC=C2)[C@@H](CN3C4=CC=CC=C4N=N3)N5C6=CC=CC=C6N=N5

InChI

InChI=1S/C28H25N7/c1-3-11-22(12-4-1)19-33(20-23-13-5-2-6-14-23)28(35-27-18-10-8-16-25(27)30-32-35)21-34-26-17-9-7-15-24(26)29-31-34/h1-18,28H,19-21H2/p+1/t28-/m1/s1