[3-methyl-5-(2-methylpropoxy)-1-phenyl-pyrazol-4-yl]methylazanium

Systemtic Name: [3-methyl-5-(2-methylpropoxy)-1-phenyl-pyrazol-4-yl]methylazanium Openeye Name: (5-isobutoxy-3-methyl-1-phenyl-pyrazol-4-yl)methylammonium CAS Name: [3-methyl-5-(2-methylpropoxy)-1-phenyl-4-pyrazolyl]methylammonium IUPAC Name: [3-methyl-5-(2-methylpropoxy)-1-phenylpyrazol-4-yl]methylazanium Traditional Name: (5-isobutoxy-3-methyl-1-phenyl-pyrazol-4-yl)methylammonium Formula: C15H22N3O+ MolecularWeight: 260.35468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C[NH3+])OCC(C)C)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C[NH3+])OCC(C)C)C2=CC=CC=C2

InChI

InChI=1S/C15H21N3O/c1-11(2)10-19-15-14(9-16)12(3)17-18(15)13-7-5-4-6-8-13/h4-8,11H,9-10,16H2,1-3H3/p+1