[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(1H-imidazol-2-ylmethyl)-methyl-azanium

Systemtic Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(1H-imidazol-2-ylmethyl)-methyl-azanium Openeye Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(1H-imidazol-2-ylmethyl)-methyl-ammonium CAS Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(1H-imidazol-2-ylmethyl)-methylammonium IUPAC Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(1H-imidazol-2-ylmethyl)-methylazanium Traditional Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(1H-imidazol-2-ylmethyl)-methyl-ammonium Formula: C17H22N5+ MolecularWeight: 296.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C=NN2)C[NH+](C)CC3=NC=CN3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C=NN2)C[NH+](C)CC3=NC=CN3)C

InChI

InChI=1S/C17H21N5/c1-12-4-5-14(8-13(12)2)17-15(9-20-21-17)10-22(3)11-16-18-6-7-19-16/h4-9H,10-11H2,1-3H3,(H,18,19)(H,20,21)/p+1