2-[(4-cyano-2-fluoranyl-phenyl)methylamino]-N-propyl-ethanamide

Systemtic Name: 2-[(4-cyano-2-fluoranyl-phenyl)methylamino]-N-propyl-ethanamide Openeye Name: 2-[(4-cyano-2-fluoro-phenyl)methylamino]-N-propyl-acetamide CAS Name: 2-[(4-cyano-2-fluorophenyl)methylamino]-N-propylacetamide IUPAC Name: 2-[(4-cyano-2-fluorophenyl)methylamino]-N-propylacetamide Traditional Name: 2-[(4-cyano-2-fluoro-benzyl)amino]-N-propyl-acetamide Formula: C13H16FN3O MolecularWeight: 249.284043

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNCC1=C(C=C(C=C1)C#N)F

Isomeric SMILES

CCCNC(=O)CNCC1=C(C=C(C=C1)C#N)F

InChI

InChI=1S/C13H16FN3O/c1-2-5-17-13(18)9-16-8-11-4-3-10(7-15)6-12(11)14/h3-4,6,16H,2,5,8-9H2,1H3,(H,17,18)