N-(2,4-dimethoxyphenyl)-1,6-diphenyl-5-(phenyldiazenyl)pyridazin-1-ium-4-amine tetrafluoroborate

Systemtic Name: N-(2,4-dimethoxyphenyl)-1,6-diphenyl-5-(phenyldiazenyl)pyridazin-1-ium-4-amine tetrafluoroborate Openeye Name: N-(2,4-dimethoxyphenyl)-1,6-diphenyl-5-phenylazo-pyridazin-1-ium-4-amine tetrafluoroborate CAS Name: N-(2,4-dimethoxyphenyl)-1,6-diphenyl-5-phenylazo-4-pyridazin-1-iumamine tetrafluoroborate IUPAC Name: N-(2,4-dimethoxyphenyl)-1,6-diphenyl-5-(phenyldiazenyl)pyridazin-1-ium-4-amine tetrafluoroborate Traditional Name: (2,4-dimethoxyphenyl)-(1,6-diphenyl-5-phenylazo-pyridazin-1-ium-4-yl)amine tetrafluoroborate Formula: C30H26BF4N5O2 MolecularWeight: 577.351171

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.COC1=CC(=C(C=C1)NC2=CN=[N+](C(=C2N=NC3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)OC

Isomeric SMILES

[B-](F)(F)(F)F.COC1=CC(=C(C=C1)NC2=CN=[N+](C(=C2[15N]=[15N]C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)OC

InChI

InChI=1S/C30H25N5O2.BF4/c1-36-25-18-19-26(28(20-25)37-2)32-27-21-31-35(24-16-10-5-11-17-24)30(22-12-6-3-7-13-22)29(27)34-33-23-14-8-4-9-15-23;2-1(3,4)5/h3-21H,1-2H3;/q;-1/p+1/i33+1,34+1;