2,2,2-tris(fluoranyl)-N-[4-oxidanylidene-1-(pyridin-4-ylmethyl)-3H-phthalazin-6-yl]ethanamide

Systemtic Name: 2,2,2-tris(fluoranyl)-N-[4-oxidanylidene-1-(pyridin-4-ylmethyl)-3H-phthalazin-6-yl]ethanamide Openeye Name: 2,2,2-trifluoro-N-[4-oxo-1-(4-pyridylmethyl)-3H-phthalazin-6-yl]acetamide CAS Name: 2,2,2-trifluoro-N-[4-oxo-1-(pyridin-4-ylmethyl)-3H-phthalazin-6-yl]acetamide IUPAC Name: 2,2,2-trifluoro-N-[4-oxo-1-(pyridin-4-ylmethyl)-3H-phthalazin-6-yl]acetamide Traditional Name: 2,2,2-trifluoro-N-[4-keto-1-(4-pyridylmethyl)-3H-phthalazin-6-yl]acetamide Formula: C16H11F3N4O2 MolecularWeight: 348.27935

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)C(F)(F)F)C(=O)NN=C2CC3=CC=NC=C3

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)C(F)(F)F)C(=O)NN=C2CC3=CC=NC=C3

InChI

InChI=1S/C16H11F3N4O2/c17-16(18,19)15(25)21-10-1-2-11-12(8-10)14(24)23-22-13(11)7-9-3-5-20-6-4-9/h1-6,8H,7H2,(H,21,25)(H,23,24)