2-[3-(cyanomethyl)-1-adamantyl]ethanenitrile

Systemtic Name: 2-[3-(cyanomethyl)-1-adamantyl]ethanenitrile Openeye Name: 2-[3-(cyanomethyl)-1-adamantyl]acetonitrile CAS Name: 2-[3-(cyanomethyl)-1-adamantyl]acetonitrile IUPAC Name: 2-[3-(cyanomethyl)-1-adamantyl]acetonitrile Traditional Name: 2-[3-(cyanomethyl)-1-adamantyl]acetonitrile Formula: C14H18N2 MolecularWeight: 214.30612

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)CC#N)CC#N

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)CC#N)CC#N

InChI

InChI=1S/C14H18N2/c15-3-1-13-6-11-5-12(7-13)9-14(8-11,10-13)2-4-16/h11-12H,1-2,5-10H2