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

Systemtic Name: N-(2,4-dimethoxyphenyl)-1,6-diphenyl-5-(phenyldiazenyl)pyridazin-1-ium-4-amine Openeye Name: N-(2,4-dimethoxyphenyl)-1,6-diphenyl-5-phenylazo-pyridazin-1-ium-4-amine CAS Name: N-(2,4-dimethoxyphenyl)-1,6-diphenyl-5-phenylazo-4-pyridazin-1-iumamine IUPAC Name: N-(2,4-dimethoxyphenyl)-1,6-diphenyl-5-(phenyldiazenyl)pyridazin-1-ium-4-amine Traditional Name: (2,4-dimethoxyphenyl)-(1,6-diphenyl-5-phenylazo-pyridazin-1-ium-4-yl)amine Formula: C30H26N5O2+ MolecularWeight: 490.546558

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Descriptors Computed from Structure

Canonical SMILES:

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

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/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/h3-21H,1-2H3/p+1/i33+1,34+1