1H-benzimidazol-2-ylmethyl-[[3-(1,3-benzodioxol-5-yl)-1-phenyl-pyrazol-4-yl]methyl]-methyl-azanium

Systemtic Name: 1H-benzimidazol-2-ylmethyl-[[3-(1,3-benzodioxol-5-yl)-1-phenyl-pyrazol-4-yl]methyl]-methyl-azanium Openeye Name: 1H-benzimidazol-2-ylmethyl-[[3-(1,3-benzodioxol-5-yl)-1-phenyl-pyrazol-4-yl]methyl]-methyl-ammonium CAS Name: 1H-benzimidazol-2-ylmethyl-[[3-(1,3-benzodioxol-5-yl)-1-phenyl-4-pyrazolyl]methyl]-methylammonium IUPAC Name: 1H-benzimidazol-2-ylmethyl-[[3-(1,3-benzodioxol-5-yl)-1-phenylpyrazol-4-yl]methyl]-methylazanium Traditional Name: 1H-benzimidazol-2-ylmethyl-[[3-(1,3-benzodioxol-5-yl)-1-phenyl-pyrazol-4-yl]methyl]-methyl-ammonium Formula: C26H24N5O2+ MolecularWeight: 438.50106

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CN(N=C1C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4)CC5=NC6=CC=CC=C6N5

Isomeric SMILES

C[NH+](CC1=CN(N=C1C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4)CC5=NC6=CC=CC=C6N5

InChI

InChI=1S/C26H23N5O2/c1-30(16-25-27-21-9-5-6-10-22(21)28-25)14-19-15-31(20-7-3-2-4-8-20)29-26(19)18-11-12-23-24(13-18)33-17-32-23/h2-13,15H,14,16-17H2,1H3,(H,27,28)/p+1