2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-phthalazin-1-yl]ethanenitrile

Systemtic Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-phthalazin-1-yl]ethanenitrile Openeye Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxo-phthalazin-1-yl]acetonitrile CAS Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxo-1-phthalazinyl]acetonitrile IUPAC Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxophthalazin-1-yl]acetonitrile Traditional Name: 2-[3-(4-fluorobenzyl)-4-keto-phthalazin-1-yl]acetonitrile Formula: C17H12FN3O MolecularWeight: 293.295083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=CC=C(C=C3)F)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=CC=C(C=C3)F)CC#N

InChI

InChI=1S/C17H12FN3O/c18-13-7-5-12(6-8-13)11-21-17(22)15-4-2-1-3-14(15)16(20-21)9-10-19/h1-8H,9,11H2