3,5-dimethyl-4-[6-(2-methylphenoxy)hexyl]-1H-pyrazole

Systemtic Name: 3,5-dimethyl-4-[6-(2-methylphenoxy)hexyl]-1H-pyrazole Openeye Name: 3,5-dimethyl-4-[6-(2-methylphenoxy)hexyl]-1H-pyrazole CAS Name: 3,5-dimethyl-4-[6-(2-methylphenoxy)hexyl]-1H-pyrazole IUPAC Name: 3,5-dimethyl-4-[6-(2-methylphenoxy)hexyl]-1H-pyrazole Traditional Name: 3,5-dimethyl-4-[6-(2-methylphenoxy)hexyl]-1H-pyrazole Formula: C18H26N2O MolecularWeight: 286.41184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCCCCC2=C(NN=C2C)C

Isomeric SMILES

CC1=CC=CC=C1OCCCCCCC2=C(NN=C2C)C

InChI

InChI=1S/C18H26N2O/c1-14-10-7-8-12-18(14)21-13-9-5-4-6-11-17-15(2)19-20-16(17)3/h7-8,10,12H,4-6,9,11,13H2,1-3H3,(H,19,20)