1-methyl-3,5-diphenyl-4-tridecoxy-pyrazole

Systemtic Name: 1-methyl-3,5-diphenyl-4-tridecoxy-pyrazole Openeye Name: 1-methyl-3,5-diphenyl-4-tridecoxy-pyrazole CAS Name: 1-methyl-3,5-diphenyl-4-tridecoxypyrazole IUPAC Name: 1-methyl-3,5-diphenyl-4-tridecoxypyrazole Traditional Name: 1-methyl-3,5-diphenyl-4-tridecoxy-pyrazole Formula: C29H40N2O MolecularWeight: 432.6407

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC1=C(N(N=C1C2=CC=CC=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCOC1=C(N(N=C1C2=CC=CC=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C29H40N2O/c1-3-4-5-6-7-8-9-10-11-12-19-24-32-29-27(25-20-15-13-16-21-25)30-31(2)28(29)26-22-17-14-18-23-26/h13-18,20-23H,3-12,19,24H2,1-2H3