2-(2,4-dimethoxyphenyl)ethyl-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]azanium

Systemtic Name: 2-(2,4-dimethoxyphenyl)ethyl-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]azanium Openeye Name: 2-(2,4-dimethoxyphenyl)ethyl-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]ammonium CAS Name: 2-(2,4-dimethoxyphenyl)ethyl-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]ammonium IUPAC Name: 2-(2,4-dimethoxyphenyl)ethyl-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]azanium Traditional Name: 2-(2,4-dimethoxyphenyl)ethyl-[[5-(2,4-dimethoxyphenyl)-1H-pyrazol-4-yl]methyl]ammonium Formula: C22H28N3O4+ MolecularWeight: 398.47542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CC[NH2+]CC2=C(NN=C2)C3=C(C=C(C=C3)OC)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CC[NH2+]CC2=C(NN=C2)C3=C(C=C(C=C3)OC)OC)OC

InChI

InChI=1S/C22H27N3O4/c1-26-17-6-5-15(20(11-17)28-3)9-10-23-13-16-14-24-25-22(16)19-8-7-18(27-2)12-21(19)29-4/h5-8,11-12,14,23H,9-10,13H2,1-4H3,(H,24,25)/p+1