6-(3-nitrophenyl)-2,4-diphenyl-3H-1,2,4,5-tetrazin-2-ium perchlorate

Systemtic Name: 6-(3-nitrophenyl)-2,4-diphenyl-3H-1,2,4,5-tetrazin-2-ium perchlorate Openeye Name: 6-(3-nitrophenyl)-2,4-diphenyl-3H-1,2,4,5-tetrazin-2-ium perchlorate CAS Name: 6-(3-nitrophenyl)-2,4-diphenyl-3H-1,2,4,5-tetrazin-2-ium perchlorate IUPAC Name: 6-(3-nitrophenyl)-2,4-diphenyl-3H-1,2,4,5-tetrazin-2-ium perchlorate Traditional Name: 6-(3-nitrophenyl)-2,4-diphenyl-3H-1,2,4,5-tetrazin-2-ium perchlorate Formula: C20H16ClN5O6 MolecularWeight: 457.82394

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Descriptors Computed from Structure

Canonical SMILES:

C1N(N=C(N=[N+]1C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1N(N=C(N=[N+]1C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C20H16N5O2.ClHO4/c26-25(27)19-13-7-8-16(14-19)20-21-23(17-9-3-1-4-10-17)15-24(22-20)18-11-5-2-6-12-18;2-1(3,4)5/h1-14H,15H2;(H,2,3,4,5)/q+1;/p-1