5-(3,4-dimethoxybiphenylen-1-yl)-2,3-diphenyl-1H-1,2,3,4-tetrazol-4-ium

Systemtic Name: 5-(3,4-dimethoxybiphenylen-1-yl)-2,3-diphenyl-1H-1,2,3,4-tetrazol-4-ium Openeye Name: 5-(3,4-dimethoxybiphenylen-1-yl)-2,3-diphenyl-1H-tetrazol-4-ium CAS Name: 5-(3,4-dimethoxy-1-biphenylenyl)-2,3-diphenyl-1H-tetrazol-4-ium IUPAC Name: 5-(3,4-dimethoxybiphenylen-1-yl)-2,3-diphenyl-1H-tetrazol-4-ium Traditional Name: 5-(3,4-dimethoxybiphenylen-1-yl)-2,3-diphenyl-1H-tetrazol-4-ium Formula: C27H23N4O2+ MolecularWeight: 435.49712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C3=CC=CC=C32)C(=C1)C4=[NH+]N(N(N4)C5=CC=CC=C5)C6=CC=CC=C6)OC

Isomeric SMILES

COC1=C(C2=C(C3=CC=CC=C32)C(=C1)C4=[NH+]N(N(N4)C5=CC=CC=C5)C6=CC=CC=C6)OC

InChI

InChI=1S/C27H22N4O2/c1-32-23-17-22(24-20-15-9-10-16-21(20)25(24)26(23)33-2)27-28-30(18-11-5-3-6-12-18)31(29-27)19-13-7-4-8-14-19/h3-17H,1-2H3,(H,28,29)/p+1