2-[(2-fluoranyl-4-oxidanyl-phenyl)amino]heptanenitrile hydrochloride

Systemtic Name: 2-[(2-fluoranyl-4-oxidanyl-phenyl)amino]heptanenitrile hydrochloride Openeye Name: 2-(2-fluoro-4-hydroxy-anilino)heptanenitrile hydrochloride CAS Name: 2-(2-fluoro-4-hydroxyanilino)heptanenitrile hydrochloride IUPAC Name: 2-(2-fluoro-4-hydroxyanilino)heptanenitrile hydrochloride Traditional Name: 2-(2-fluoro-4-hydroxy-anilino)enanthonitrile hydrochloride Formula: C13H18ClFN2O MolecularWeight: 272.746223

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C#N)NC1=C(C=C(C=C1)O)F.Cl

Isomeric SMILES

CCCCCC(C#N)NC1=C(C=C(C=C1)O)F.Cl

InChI

InChI=1S/C13H17FN2O.ClH/c1-2-3-4-5-10(9-15)16-13-7-6-11(17)8-12(13)14;/h6-8,10,16-17H,2-5H2,1H3;1H