6-[2,3-bis(oxidanyl)propoxy]-N-[4-oxidanylidene-3-[3-(trifluoromethyl)phenyl]phthalazin-5-yl]pyridine-2-carboxamide

Systemtic Name: 6-[2,3-bis(oxidanyl)propoxy]-N-[4-oxidanylidene-3-[3-(trifluoromethyl)phenyl]phthalazin-5-yl]pyridine-2-carboxamide Openeye Name: 6-(2,3-dihydroxypropoxy)-N-[4-oxo-3-[3-(trifluoromethyl)phenyl]phthalazin-5-yl]pyridine-2-carboxamide CAS Name: 6-(2,3-dihydroxypropoxy)-N-[4-oxo-3-[3-(trifluoromethyl)phenyl]-5-phthalazinyl]-2-pyridinecarboxamide IUPAC Name: 6-(2,3-dihydroxypropoxy)-N-[4-oxo-3-[3-(trifluoromethyl)phenyl]phthalazin-5-yl]pyridine-2-carboxamide Traditional Name: 6-glyceryloxy-N-[4-keto-3-[3-(trifluoromethyl)phenyl]phthalazin-5-yl]picolinamide Formula: C24H19F3N4O5 MolecularWeight: 500.42667

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C(=O)C3=C(C=CC=C3NC(=O)C4=NC(=CC=C4)OCC(CO)O)C=N2)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)N2C(=O)C3=C(C=CC=C3NC(=O)C4=NC(=CC=C4)OCC(CO)O)C=N2)C(F)(F)F

InChI

InChI=1S/C24H19F3N4O5/c25-24(26,27)15-5-2-6-16(10-15)31-23(35)21-14(11-28-31)4-1-7-18(21)30-22(34)19-8-3-9-20(29-19)36-13-17(33)12-32/h1-11,17,32-33H,12-13H2,(H,30,34)