3-[(3-ethoxypropylamino)methyl]-4-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[(3-ethoxypropylamino)methyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 3-[(3-ethoxypropylamino)methyl]-4-fluoro-benzonitrile CAS Name: 3-[(3-ethoxypropylamino)methyl]-4-fluorobenzonitrile IUPAC Name: 3-[(3-ethoxypropylamino)methyl]-4-fluorobenzonitrile Traditional Name: 3-[(3-ethoxypropylamino)methyl]-4-fluoro-benzonitrile Formula: C13H17FN2O MolecularWeight: 236.285283

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNCC1=C(C=CC(=C1)C#N)F

Isomeric SMILES

CCOCCCNCC1=C(C=CC(=C1)C#N)F

InChI

InChI=1S/C13H17FN2O/c1-2-17-7-3-6-16-10-12-8-11(9-15)4-5-13(12)14/h4-5,8,16H,2-3,6-7,10H2,1H3