1-[(4-tert-butylphenoxy)methyl]-N-octadecyl-pyrazole-3-carboxamide

Systemtic Name: 1-[(4-tert-butylphenoxy)methyl]-N-octadecyl-pyrazole-3-carboxamide Openeye Name: 1-[(4-tert-butylphenoxy)methyl]-N-octadecyl-pyrazole-3-carboxamide CAS Name: 1-[(4-tert-butylphenoxy)methyl]-N-octadecyl-3-pyrazolecarboxamide IUPAC Name: 1-[(4-tert-butylphenoxy)methyl]-N-octadecylpyrazole-3-carboxamide Traditional Name: 1-[(4-tert-butylphenoxy)methyl]-N-stearyl-pyrazole-3-carboxamide Formula: C33H55N3O2 MolecularWeight: 525.8087

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1=NN(C=C1)COC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1=NN(C=C1)COC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C33H55N3O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26-34-32(37)31-25-27-36(35-31)28-38-30-23-21-29(22-24-30)33(2,3)4/h21-25,27H,5-20,26,28H2,1-4H3,(H,34,37)