4-(4-chloranylphthalazin-1-yl)-N-[4-(trifluoromethyloxy)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-(4-chloranylphthalazin-1-yl)-N-[4-(trifluoromethyloxy)phenyl]piperazine-1-carboxamide Openeye Name: 4-(4-chlorophthalazin-1-yl)-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carboxamide CAS Name: 4-(4-chloro-1-phthalazinyl)-N-[4-(trifluoromethoxy)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-chlorophthalazin-1-yl)-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carboxamide Traditional Name: 4-(4-chlorophthalazin-1-yl)-N-[4-(trifluoromethoxy)phenyl]piperazine-1-carboxamide Formula: C20H17ClF3N5O2 MolecularWeight: 451.82949

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C3=CC=CC=C32)Cl)C(=O)NC4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=NN=C(C3=CC=CC=C32)Cl)C(=O)NC4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C20H17ClF3N5O2/c21-17-15-3-1-2-4-16(15)18(27-26-17)28-9-11-29(12-10-28)19(30)25-13-5-7-14(8-6-13)31-20(22,23)24/h1-8H,9-12H2,(H,25,30)