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

Systemtic Name: 5-(3-chlorophenyl)-2-phenyl-3-(4-phenylmethoxyphenyl)-1,2,3,4-tetrazol-3-ium Openeye Name: 2-(4-benzyloxyphenyl)-5-(3-chlorophenyl)-3-phenyl-tetrazol-2-ium CAS Name: 5-(3-chlorophenyl)-2-phenyl-3-(4-phenylmethoxyphenyl)tetrazol-3-ium IUPAC Name: 5-(3-chlorophenyl)-2-phenyl-3-(4-phenylmethoxyphenyl)tetrazol-3-ium Traditional Name: 2-(4-benzoxyphenyl)-5-(3-chlorophenyl)-3-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)C5=CC(=CC=C5)Cl

Isomeric SMILES

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

InChI

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