3-[(4-ethanoyl-2-fluoranyl-phenyl)-methyl-amino]propanenitrile

Systemtic Name: 3-[(4-ethanoyl-2-fluoranyl-phenyl)-methyl-amino]propanenitrile Openeye Name: 3-(4-acetyl-2-fluoro-N-methyl-anilino)propanenitrile CAS Name: 3-(4-acetyl-2-fluoro-N-methylanilino)propanenitrile IUPAC Name: 3-(4-acetyl-2-fluoro-N-methylanilino)propanenitrile Traditional Name: 3-(4-acetyl-2-fluoro-N-methyl-anilino)propionitrile Formula: C12H13FN2O MolecularWeight: 220.242823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13FN2O/c1-9(16)10-4-5-12(11(13)8-10)15(2)7-3-6-14/h4-5,8H,3,7H2,1-2H3