2-(3-chlorophenyl)-5-phenyl-3-(4-phenylmethoxyphenyl)-1,2,3,4-tetrazol-3-ium

Systemtic Name: 2-(3-chlorophenyl)-5-phenyl-3-(4-phenylmethoxyphenyl)-1,2,3,4-tetrazol-3-ium Openeye Name: 2-(4-benzyloxyphenyl)-3-(3-chlorophenyl)-5-phenyl-tetrazol-2-ium CAS Name: 2-(3-chlorophenyl)-5-phenyl-3-(4-phenylmethoxyphenyl)tetrazol-3-ium IUPAC Name: 2-(3-chlorophenyl)-5-phenyl-3-(4-phenylmethoxyphenyl)tetrazol-3-ium Traditional Name: 2-(4-benzoxyphenyl)-3-(3-chlorophenyl)-5-phenyl-tetrazol-2-ium Formula: C26H20ClN4O+ MolecularWeight: 439.9162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)[N+]3=NC(=NN3C4=CC(=CC=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)[N+]3=NC(=NN3C4=CC(=CC=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C26H20ClN4O/c27-22-12-7-13-24(18-22)31-29-26(21-10-5-2-6-11-21)28-30(31)23-14-16-25(17-15-23)32-19-20-8-3-1-4-9-20/h1-18H,19H2/q+1