2-[[2-(1-azanylethyl)-4-fluoranyl-phenyl]-(cyanomethyl)amino]ethanenitrile

Systemtic Name: 2-[[2-(1-azanylethyl)-4-fluoranyl-phenyl]-(cyanomethyl)amino]ethanenitrile Openeye Name: 2-[2-(1-aminoethyl)-N-(cyanomethyl)-4-fluoro-anilino]acetonitrile CAS Name: 2-[2-(1-aminoethyl)-N-(cyanomethyl)-4-fluoroanilino]acetonitrile IUPAC Name: 2-[2-(1-aminoethyl)-N-(cyanomethyl)-4-fluoroanilino]acetonitrile Traditional Name: 2-[2-(1-aminoethyl)-N-(cyanomethyl)-4-fluoro-anilino]acetonitrile Formula: C12H13FN4 MolecularWeight: 232.256823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13FN4/c1-9(16)11-8-10(13)2-3-12(11)17(6-4-14)7-5-15/h2-3,8-9H,6-7,16H2,1H3