2-methyl-3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-octadecyl-propanamide

Systemtic Name: 2-methyl-3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-octadecyl-propanamide Openeye Name: 2-methyl-3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-octadecyl-propanamide CAS Name: 2-methyl-3-[5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-N-octadecylpropanamide IUPAC Name: 2-methyl-3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-octadecylpropanamide Traditional Name: 2-methyl-3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-stearyl-propionamide Formula: C27H48F3N3O MolecularWeight: 487.68473

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C(C)CN1C(=CC(=N1)C(F)(F)F)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C(C)CN1C(=CC(=N1)C(F)(F)F)C

InChI

InChI=1S/C27H48F3N3O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-31-26(34)23(2)22-33-24(3)21-25(32-33)27(28,29)30/h21,23H,4-20,22H2,1-3H3,(H,31,34)