3-(1-adamantyl)-2-(1-phenylethylamino)propanenitrile

Systemtic Name: 3-(1-adamantyl)-2-(1-phenylethylamino)propanenitrile Openeye Name: 3-(1-adamantyl)-2-(1-phenylethylamino)propanenitrile CAS Name: 3-(1-adamantyl)-2-(1-phenylethylamino)propanenitrile IUPAC Name: 3-(1-adamantyl)-2-(1-phenylethylamino)propanenitrile Traditional Name: 3-(1-adamantyl)-2-(1-phenylethylamino)propionitrile Formula: C21H28N2 MolecularWeight: 308.46042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(CC23CC4CC(C2)CC(C4)C3)C#N

Isomeric SMILES

CC(C1=CC=CC=C1)NC(CC23CC4CC(C2)CC(C4)C3)C#N

InChI

InChI=1S/C21H28N2/c1-15(19-5-3-2-4-6-19)23-20(14-22)13-21-10-16-7-17(11-21)9-18(8-16)12-21/h2-6,15-18,20,23H,7-13H2,1H3