2-[2-(phenylmethyl)-2-adamantyl]ethanenitrile

Systemtic Name: 2-[2-(phenylmethyl)-2-adamantyl]ethanenitrile Openeye Name: 2-(2-benzyl-2-adamantyl)acetonitrile CAS Name: 2-[2-(phenylmethyl)-2-adamantyl]acetonitrile IUPAC Name: 2-(2-benzyl-2-adamantyl)acetonitrile Traditional Name: 2-(2-benzyl-2-adamantyl)acetonitrile Formula: C19H23N MolecularWeight: 265.39262

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3(CC#N)CC4=CC=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)C3(CC#N)CC4=CC=CC=C4

InChI

InChI=1S/C19H23N/c20-7-6-19(13-14-4-2-1-3-5-14)17-9-15-8-16(11-17)12-18(19)10-15/h1-5,15-18H,6,8-13H2