N-[2-(3-fluoranylphenoxy)ethyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[2-(3-fluoranylphenoxy)ethyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[2-(3-fluorophenoxy)ethyl]-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[2-(3-fluorophenoxy)ethyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[2-(3-fluorophenoxy)ethyl]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-[2-(3-fluorophenoxy)ethyl]-4-keto-phthalazine-1-carboxamide Formula: C22H24FN3O3 MolecularWeight: 397.442663

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCOC3=CC(=CC=C3)F

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCOC3=CC(=CC=C3)F

InChI

InChI=1S/C22H24FN3O3/c1-2-3-6-13-26-22(28)19-11-5-4-10-18(19)20(25-26)21(27)24-12-14-29-17-9-7-8-16(23)15-17/h4-5,7-11,15H,2-3,6,12-14H2,1H3,(H,24,27)