2-[(3S)-3-phenyl-2-bicyclo[2.2.2]octanyl]ethanenitrile

Systemtic Name: 2-[(3S)-3-phenyl-2-bicyclo[2.2.2]octanyl]ethanenitrile Openeye Name: 2-[(3S)-3-phenyl-2-bicyclo[2.2.2]octanyl]acetonitrile CAS Name: 2-[(3S)-3-phenyl-2-bicyclo[2.2.2]octanyl]acetonitrile IUPAC Name: 2-[(3S)-3-phenyl-2-bicyclo[2.2.2]octanyl]acetonitrile Traditional Name: 2-[(3S)-3-phenyl-2-bicyclo[2.2.2]octanyl]acetonitrile Formula: C16H19N MolecularWeight: 225.32876

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CCC1C(C2C3=CC=CC=C3)CC#N

Isomeric SMILES

C1CC2CCC1[C@@H](C2CC#N)C3=CC=CC=C3

InChI

InChI=1S/C16H19N/c17-11-10-15-12-6-8-14(9-7-12)16(15)13-4-2-1-3-5-13/h1-5,12,14-16H,6-10H2/t12?,14?,15?,16-/m0/s1