2-[cyanomethyl-(2-ethanoyl-4-fluoranyl-phenyl)amino]ethanenitrile

Systemtic Name: 2-[cyanomethyl-(2-ethanoyl-4-fluoranyl-phenyl)amino]ethanenitrile Openeye Name: 2-[2-acetyl-N-(cyanomethyl)-4-fluoro-anilino]acetonitrile CAS Name: 2-[2-acetyl-N-(cyanomethyl)-4-fluoroanilino]acetonitrile IUPAC Name: 2-[2-acetyl-N-(cyanomethyl)-4-fluoroanilino]acetonitrile Traditional Name: 2-[2-acetyl-N-(cyanomethyl)-4-fluoro-anilino]acetonitrile Formula: C12H10FN3O MolecularWeight: 231.225703

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)F)N(CC#N)CC#N

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)F)N(CC#N)CC#N

InChI

InChI=1S/C12H10FN3O/c1-9(17)11-8-10(13)2-3-12(11)16(6-4-14)7-5-15/h2-3,8H,6-7H2,1H3