[3-(2,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: [3-(2,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methyl-(pyridin-3-ylmethyl)azanium Openeye Name: [3-(2,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methyl-(3-pyridylmethyl)ammonium CAS Name: [3-(2,4-dimethylphenyl)-1-phenyl-4-pyrazolyl]methyl-(3-pyridinylmethyl)ammonium IUPAC Name: [3-(2,4-dimethylphenyl)-1-phenylpyrazol-4-yl]methyl-(pyridin-3-ylmethyl)azanium Traditional Name: [3-(2,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]methyl-(3-pyridylmethyl)ammonium Formula: C24H25N4+ MolecularWeight: 369.4821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NN(C=C2C[NH2+]CC3=CN=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NN(C=C2C[NH2+]CC3=CN=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C24H24N4/c1-18-10-11-23(19(2)13-18)24-21(16-26-15-20-7-6-12-25-14-20)17-28(27-24)22-8-4-3-5-9-22/h3-14,17,26H,15-16H2,1-2H3/p+1