N-[(Z)-1-(4-fluorophenyl)pentylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-1-(4-fluorophenyl)pentylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(Z)-1-(4-fluorophenyl)pentylideneamino]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(Z)-1-(4-fluorophenyl)pentylideneamino]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(Z)-1-(4-fluorophenyl)pentylideneamino]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[(Z)-1-(4-fluorophenyl)pentylideneamino]-4-keto-3H-phthalazine-1-carboxamide Formula: C20H19FN4O2 MolecularWeight: 366.388863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NNC(=O)C1=NNC(=O)C2=CC=CC=C21)C3=CC=C(C=C3)F

Isomeric SMILES

CCCC/C(=N/NC(=O)C1=NNC(=O)C2=CC=CC=C21)/C3=CC=C(C=C3)F

InChI

InChI=1S/C20H19FN4O2/c1-2-3-8-17(13-9-11-14(21)12-10-13)22-25-20(27)18-15-6-4-5-7-16(15)19(26)24-23-18/h4-7,9-12H,2-3,8H2,1H3,(H,24,26)(H,25,27)/b22-17-