4-(azepan-1-yl)-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-(azepan-1-yl)-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-(azepan-1-yl)-3-fluoro-benzonitrile CAS Name: 4-(1-azepanyl)-3-fluorobenzonitrile IUPAC Name: 4-(azepan-1-yl)-3-fluorobenzonitrile Traditional Name: 4-(azepan-1-yl)-3-fluoro-benzonitrile Formula: C13H15FN2 MolecularWeight: 218.270003

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)C#N)F

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C13H15FN2/c14-12-9-11(10-15)5-6-13(12)16-7-3-1-2-4-8-16/h5-6,9H,1-4,7-8H2