5-[4-(2-methylpropyl)phenyl]-1H-pyrazole-4-carbaldehyde

Systemtic Name: 5-[4-(2-methylpropyl)phenyl]-1H-pyrazole-4-carbaldehyde Openeye Name: 5-(4-isobutylphenyl)-1H-pyrazole-4-carbaldehyde CAS Name: 5-[4-(2-methylpropyl)phenyl]-1H-pyrazole-4-carboxaldehyde IUPAC Name: 5-[4-(2-methylpropyl)phenyl]-1H-pyrazole-4-carbaldehyde Traditional Name: 5-(4-isobutylphenyl)-1H-pyrazole-4-carbaldehyde Formula: C14H16N2O MolecularWeight: 228.28964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C2=C(C=NN2)C=O

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C2=C(C=NN2)C=O

InChI

InChI=1S/C14H16N2O/c1-10(2)7-11-3-5-12(6-4-11)14-13(9-17)8-15-16-14/h3-6,8-10H,7H2,1-2H3,(H,15,16)