3-[4-[bis(fluoranyl)methoxy]phenyl]-N-octadecyl-1H-pyrazole-5-carboxamide

Systemtic Name: 3-[4-[bis(fluoranyl)methoxy]phenyl]-N-octadecyl-1H-pyrazole-5-carboxamide Openeye Name: 3-[4-(difluoromethoxy)phenyl]-N-octadecyl-1H-pyrazole-5-carboxamide CAS Name: 3-[4-(difluoromethoxy)phenyl]-N-octadecyl-1H-pyrazole-5-carboxamide IUPAC Name: 3-[4-(difluoromethoxy)phenyl]-N-octadecyl-1H-pyrazole-5-carboxamide Traditional Name: 3-[4-(difluoromethoxy)phenyl]-N-stearyl-1H-pyrazole-5-carboxamide Formula: C29H45F2N3O2 MolecularWeight: 505.683306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1=CC(=NN1)C2=CC=C(C=C2)OC(F)F

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1=CC(=NN1)C2=CC=C(C=C2)OC(F)F

InChI

InChI=1S/C29H45F2N3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-32-28(35)27-23-26(33-34-27)24-18-20-25(21-19-24)36-29(30)31/h18-21,23,29H,2-17,22H2,1H3,(H,32,35)(H,33,34)