4-[(4-fluoranyl-3-pyridin-4-yl-phenyl)methyl]-5,6,7,8-tetrahydro-2H-phthalazin-1-one

Systemtic Name: 4-[(4-fluoranyl-3-pyridin-4-yl-phenyl)methyl]-5,6,7,8-tetrahydro-2H-phthalazin-1-one Openeye Name: 4-[[4-fluoro-3-(4-pyridyl)phenyl]methyl]-5,6,7,8-tetrahydro-2H-phthalazin-1-one CAS Name: 4-[(4-fluoro-3-pyridin-4-ylphenyl)methyl]-5,6,7,8-tetrahydro-2H-phthalazin-1-one IUPAC Name: 4-[(4-fluoro-3-pyridin-4-ylphenyl)methyl]-5,6,7,8-tetrahydro-2H-phthalazin-1-one Traditional Name: 4-[4-fluoro-3-(4-pyridyl)benzyl]-5,6,7,8-tetrahydro-2H-phthalazin-1-one Formula: C20H18FN3O MolecularWeight: 335.374823

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=NNC2=O)CC3=CC(=C(C=C3)F)C4=CC=NC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=NNC2=O)CC3=CC(=C(C=C3)F)C4=CC=NC=C4

InChI

InChI=1S/C20H18FN3O/c21-18-6-5-13(11-17(18)14-7-9-22-10-8-14)12-19-15-3-1-2-4-16(15)20(25)24-23-19/h5-11H,1-4,12H2,(H,24,25)