4-[(2,4-dimethoxyphenyl)methyl]-2-methyl-1H-pyrazol-2-ium-3-amine

Systemtic Name: 4-[(2,4-dimethoxyphenyl)methyl]-2-methyl-1H-pyrazol-2-ium-3-amine Openeye Name: 4-[(2,4-dimethoxyphenyl)methyl]-2-methyl-1H-pyrazol-2-ium-3-amine CAS Name: 4-[(2,4-dimethoxyphenyl)methyl]-2-methyl-1H-pyrazol-2-ium-3-amine IUPAC Name: 4-[(2,4-dimethoxyphenyl)methyl]-2-methyl-1H-pyrazol-2-ium-3-amine Traditional Name: [4-(2,4-dimethoxybenzyl)-2-methyl-1H-pyrazol-2-ium-3-yl]amine Formula: C13H18N3O2+ MolecularWeight: 248.30092

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C(=CN1)CC2=C(C=C(C=C2)OC)OC)N

Isomeric SMILES

C[N+]1=C(C(=CN1)CC2=C(C=C(C=C2)OC)OC)N

InChI

InChI=1S/C13H17N3O2/c1-16-13(14)10(8-15-16)6-9-4-5-11(17-2)7-12(9)18-3/h4-5,7-8H,6H2,1-3H3,(H2,14,15)/p+1