3-butyl-N'-[2-(2-fluoranylphenoxy)ethanoyl]-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: 3-butyl-N'-[2-(2-fluoranylphenoxy)ethanoyl]-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: 3-butyl-N'-[2-(2-fluorophenoxy)acetyl]-4-oxo-phthalazine-1-carbohydrazide CAS Name: 3-butyl-N'-[2-(2-fluorophenoxy)-1-oxoethyl]-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: 3-butyl-N'-[2-(2-fluorophenoxy)acetyl]-4-oxophthalazine-1-carbohydrazide Traditional Name: 3-butyl-N'-[2-(2-fluorophenoxy)acetyl]-4-keto-phthalazine-1-carbohydrazide Formula: C21H21FN4O4 MolecularWeight: 412.414243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)COC3=CC=CC=C3F

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)COC3=CC=CC=C3F

InChI

InChI=1S/C21H21FN4O4/c1-2-3-12-26-21(29)15-9-5-4-8-14(15)19(25-26)20(28)24-23-18(27)13-30-17-11-7-6-10-16(17)22/h4-11H,2-3,12-13H2,1H3,(H,23,27)(H,24,28)