2-(azepan-1-yl)-2-phenyl-ethanenitrile

Systemtic Name: 2-(azepan-1-yl)-2-phenyl-ethanenitrile Openeye Name: 2-(azepan-1-yl)-2-phenyl-acetonitrile CAS Name: 2-(1-azepanyl)-2-phenylacetonitrile IUPAC Name: 2-(azepan-1-yl)-2-phenylacetonitrile Traditional Name: 2-(azepan-1-yl)-2-phenyl-acetonitrile Formula: C14H18N2 MolecularWeight: 214.30612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2/c15-12-14(13-8-4-3-5-9-13)16-10-6-1-2-7-11-16/h3-5,8-9,14H,1-2,6-7,10-11H2