4-[[4-fluoranyl-3-(4-pyridin-4-yloxypiperidin-1-yl)carbonyl-phenyl]methyl]-2H-phthalazin-1-one

Systemtic Name: 4-[[4-fluoranyl-3-(4-pyridin-4-yloxypiperidin-1-yl)carbonyl-phenyl]methyl]-2H-phthalazin-1-one Openeye Name: 4-[[4-fluoro-3-[4-(4-pyridyloxy)piperidine-1-carbonyl]phenyl]methyl]-2H-phthalazin-1-one CAS Name: 4-[[4-fluoro-3-[oxo-(4-pyridin-4-yloxy-1-piperidinyl)methyl]phenyl]methyl]-2H-phthalazin-1-one IUPAC Name: 4-[[4-fluoro-3-(4-pyridin-4-yloxypiperidine-1-carbonyl)phenyl]methyl]-2H-phthalazin-1-one Traditional Name: 4-[4-fluoro-3-[4-(4-pyridyloxy)piperidine-1-carbonyl]benzyl]-2H-phthalazin-1-one Formula: C26H23FN4O3 MolecularWeight: 458.484223

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC=NC=C2)C(=O)C3=C(C=CC(=C3)CC4=NNC(=O)C5=CC=CC=C54)F

Isomeric SMILES

C1CN(CCC1OC2=CC=NC=C2)C(=O)C3=C(C=CC(=C3)CC4=NNC(=O)C5=CC=CC=C54)F

InChI

InChI=1S/C26H23FN4O3/c27-23-6-5-17(16-24-20-3-1-2-4-21(20)25(32)30-29-24)15-22(23)26(33)31-13-9-19(10-14-31)34-18-7-11-28-12-8-18/h1-8,11-12,15,19H,9-10,13-14,16H2,(H,30,32)