[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-ethyl-(2-hydroxyethyl)azanium

Systemtic Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-ethyl-(2-hydroxyethyl)azanium Openeye Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-ethyl-(2-hydroxyethyl)ammonium CAS Name: [1-(2,5-dimethylphenyl)-3-phenyl-4-pyrazolyl]methyl-ethyl-(2-hydroxyethyl)ammonium IUPAC Name: [1-(2,5-dimethylphenyl)-3-phenylpyrazol-4-yl]methyl-ethyl-(2-hydroxyethyl)azanium Traditional Name: [1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl-ethyl-(2-hydroxyethyl)ammonium Formula: C22H28N3O+ MolecularWeight: 350.47722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCO)CC1=CN(N=C1C2=CC=CC=C2)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CC[NH+](CCO)CC1=CN(N=C1C2=CC=CC=C2)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C22H27N3O/c1-4-24(12-13-26)15-20-16-25(21-14-17(2)10-11-18(21)3)23-22(20)19-8-6-5-7-9-19/h5-11,14,16,26H,4,12-13,15H2,1-3H3/p+1