2-(1-adamantylamino)-2-phenyl-ethanenitrile

Systemtic Name: 2-(1-adamantylamino)-2-phenyl-ethanenitrile Openeye Name: 2-(1-adamantylamino)-2-phenyl-acetonitrile CAS Name: 2-(1-adamantylamino)-2-phenylacetonitrile IUPAC Name: 2-(1-adamantylamino)-2-phenylacetonitrile Traditional Name: 2-(1-adamantylamino)-2-phenyl-acetonitrile Formula: C18H22N2 MolecularWeight: 266.38068

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(C#N)C4=CC=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(C#N)C4=CC=CC=C4

InChI

InChI=1S/C18H22N2/c19-12-17(16-4-2-1-3-5-16)20-18-9-13-6-14(10-18)8-15(7-13)11-18/h1-5,13-15,17,20H,6-11H2