[1-phenyl-3-(4-propan-2-ylphenyl)pyrazol-4-yl]methylazanium

Systemtic Name: [1-phenyl-3-(4-propan-2-ylphenyl)pyrazol-4-yl]methylazanium Openeye Name: [3-(4-isopropylphenyl)-1-phenyl-pyrazol-4-yl]methylammonium CAS Name: [1-phenyl-3-(4-propan-2-ylphenyl)-4-pyrazolyl]methylammonium IUPAC Name: [1-phenyl-3-(4-propan-2-ylphenyl)pyrazol-4-yl]methylazanium Traditional Name: (3-p-cumenyl-1-phenyl-pyrazol-4-yl)methylammonium Formula: C19H22N3+ MolecularWeight: 292.39808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NN(C=C2C[NH3+])C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NN(C=C2C[NH3+])C3=CC=CC=C3

InChI

InChI=1S/C19H21N3/c1-14(2)15-8-10-16(11-9-15)19-17(12-20)13-22(21-19)18-6-4-3-5-7-18/h3-11,13-14H,12,20H2,1-2H3/p+1