2-oxidanylidene-3-phenyl-azocane-3-carbonitrile

Systemtic Name: 2-oxidanylidene-3-phenyl-azocane-3-carbonitrile Openeye Name: 2-oxo-3-phenyl-azocane-3-carbonitrile CAS Name: 2-oxo-3-phenyl-3-azocanecarbonitrile IUPAC Name: 2-oxo-3-phenylazocane-3-carbonitrile Traditional Name: 2-keto-3-phenyl-azocane-3-carbonitrile Formula: C14H16N2O MolecularWeight: 228.28964

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(=O)NCC1)(C#N)C2=CC=CC=C2

Isomeric SMILES

C1CCC(C(=O)NCC1)(C#N)C2=CC=CC=C2

InChI

InChI=1S/C14H16N2O/c15-11-14(12-7-3-1-4-8-12)9-5-2-6-10-16-13(14)17/h1,3-4,7-8H,2,5-6,9-10H2,(H,16,17)