4-(3-fluorophenyl)-7-oxidanylidene-azepane-4-carbonitrile

Systemtic Name: 4-(3-fluorophenyl)-7-oxidanylidene-azepane-4-carbonitrile Openeye Name: 4-(3-fluorophenyl)-7-oxo-azepane-4-carbonitrile CAS Name: 4-(3-fluorophenyl)-7-oxo-4-azepanecarbonitrile IUPAC Name: 4-(3-fluorophenyl)-7-oxoazepane-4-carbonitrile Traditional Name: 4-(3-fluorophenyl)-7-keto-azepane-4-carbonitrile Formula: C13H13FN2O MolecularWeight: 232.253523

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCNC1=O)(C#N)C2=CC(=CC=C2)F

Isomeric SMILES

C1CC(CCNC1=O)(C#N)C2=CC(=CC=C2)F

InChI

InChI=1S/C13H13FN2O/c14-11-3-1-2-10(8-11)13(9-15)5-4-12(17)16-7-6-13/h1-3,8H,4-7H2,(H,16,17)