N'-[2-(4-fluoranylphenoxy)propanoyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: N'-[2-(4-fluoranylphenoxy)propanoyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: N'-[2-(4-fluorophenoxy)propanoyl]-3-isobutyl-4-oxo-phthalazine-1-carbohydrazide CAS Name: N'-[2-(4-fluorophenoxy)-1-oxopropyl]-3-(2-methylpropyl)-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: N'-[2-(4-fluorophenoxy)propanoyl]-3-(2-methylpropyl)-4-oxophthalazine-1-carbohydrazide Traditional Name: N'-[2-(4-fluorophenoxy)propanoyl]-3-isobutyl-4-keto-phthalazine-1-carbohydrazide Formula: C22H23FN4O4 MolecularWeight: 426.440823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C(C)OC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C(C)OC3=CC=C(C=C3)F

InChI

InChI=1S/C22H23FN4O4/c1-13(2)12-27-22(30)18-7-5-4-6-17(18)19(26-27)21(29)25-24-20(28)14(3)31-16-10-8-15(23)9-11-16/h4-11,13-14H,12H2,1-3H3,(H,24,28)(H,25,29)