3-(5,6-dimethoxybiphenylen-1-yl)-1-(3-nitrophenyl)-1,2,3,4-tetrazol-1-ium

Systemtic Name: 3-(5,6-dimethoxybiphenylen-1-yl)-1-(3-nitrophenyl)-1,2,3,4-tetrazol-1-ium Openeye Name: 3-(5,6-dimethoxybiphenylen-1-yl)-1-(3-nitrophenyl)tetrazol-1-ium CAS Name: 3-(5,6-dimethoxy-1-biphenylenyl)-1-(3-nitrophenyl)tetrazol-1-ium IUPAC Name: 3-(5,6-dimethoxybiphenylen-1-yl)-1-(3-nitrophenyl)tetrazol-1-ium Traditional Name: 3-(5,6-dimethoxybiphenylen-1-yl)-1-(3-nitrophenyl)tetrazol-1-ium Formula: C21H16N5O4+ MolecularWeight: 402.38284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C3=C2C=CC=C3N4N=C[N+](=N4)C5=CC(=CC=C5)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C3=C2C=CC=C3N4N=C[N+](=N4)C5=CC(=CC=C5)[N+](=O)[O-])OC

InChI

InChI=1S/C21H16N5O4/c1-29-18-10-9-16-19-15(20(16)21(18)30-2)7-4-8-17(19)25-22-12-24(23-25)13-5-3-6-14(11-13)26(27)28/h3-12H,1-2H3/q+1