2-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methylamino]ethyl-dimethylammonium IUPAC Name: 2-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methylamino]ethyl-dimethylazanium Traditional Name: 2-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methylamino]ethyl-dimethyl-ammonium Formula: C16H25N4+ MolecularWeight: 273.3965

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C=NN2)CNCC[NH+](C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C=NN2)CNCC[NH+](C)C)C

InChI

InChI=1S/C16H24N4/c1-12-5-6-14(9-13(12)2)16-15(11-18-19-16)10-17-7-8-20(3)4/h5-6,9,11,17H,7-8,10H2,1-4H3,(H,18,19)/p+1