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

Systemtic Name: 4-(azepan-1-ylcarbonyl)-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-(azepane-1-carbonyl)-3-fluoro-benzonitrile CAS Name: 4-[1-azepanyl(oxo)methyl]-3-fluorobenzonitrile IUPAC Name: 4-(azepane-1-carbonyl)-3-fluorobenzonitrile Traditional Name: 4-(azepane-1-carbonyl)-3-fluoro-benzonitrile Formula: C14H15FN2O MolecularWeight: 246.280103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15FN2O/c15-13-9-11(10-16)5-6-12(13)14(18)17-7-3-1-2-4-8-17/h5-6,9H,1-4,7-8H2