3-[4-(2-pyrrolidin-1-ylethoxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one

Systemtic Name: 3-[4-(2-pyrrolidin-1-ylethoxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Openeye Name: 3-[4-(2-pyrrolidin-1-ylethoxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one CAS Name: 3-[4-[2-(1-pyrrolidinyl)ethoxy]-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-(2-pyrrolidin-1-ylethoxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Traditional Name: 3-[4-(2-pyrrolidinoethoxy)-3-(trifluoromethyl)phenyl]-1H-pyridazin-6-one Formula: C17H18F3N3O2 MolecularWeight: 353.33893

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=C(C=C(C=C2)C3=NNC(=O)C=C3)C(F)(F)F

Isomeric SMILES

C1CCN(C1)CCOC2=C(C=C(C=C2)C3=NNC(=O)C=C3)C(F)(F)F

InChI

InChI=1S/C17H18F3N3O2/c18-17(19,20)13-11-12(14-4-6-16(24)22-21-14)3-5-15(13)25-10-9-23-7-1-2-8-23/h3-6,11H,1-2,7-10H2,(H,22,24)