5-[2-(2-methylpropoxy)-5-phenethyl-phenyl]-1H-pyrazole

Systemtic Name: 5-[2-(2-methylpropoxy)-5-phenethyl-phenyl]-1H-pyrazole Openeye Name: 5-(2-isobutoxy-5-phenethyl-phenyl)-1H-pyrazole CAS Name: 5-[2-(2-methylpropoxy)-5-phenethylphenyl]-1H-pyrazole IUPAC Name: 5-[2-(2-methylpropoxy)-5-phenethylphenyl]-1H-pyrazole Traditional Name: 5-(2-isobutoxy-5-phenethyl-phenyl)-1H-pyrazole Formula: C21H24N2O MolecularWeight: 320.42806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)CCC2=CC=CC=C2)C3=CC=NN3

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)CCC2=CC=CC=C2)C3=CC=NN3

InChI

InChI=1S/C21H24N2O/c1-16(2)15-24-21-11-10-18(9-8-17-6-4-3-5-7-17)14-19(21)20-12-13-22-23-20/h3-7,10-14,16H,8-9,15H2,1-2H3,(H,22,23)