2-[[(1R,5S)-7-bromanyl-6-phenyl-6-bicyclo[3.1.1]heptanyl]imino]propanenitrile

Systemtic Name: 2-[[(1R,5S)-7-bromanyl-6-phenyl-6-bicyclo[3.1.1]heptanyl]imino]propanenitrile Openeye Name: N-[(1R,5S)-7-bromo-6-phenyl-norpinan-6-yl]acetimidoyl cyanide CAS Name: 2-[[(1R,5S)-7-bromo-6-phenyl-6-bicyclo[3.1.1]heptanyl]imino]propanenitrile IUPAC Name: N-[(1R,5S)-7-bromo-6-phenyl-6-bicyclo[3.1.1]heptanyl]ethanimidoyl cyanide Traditional Name: 2-[(1R,5S)-7-bromo-6-phenyl-norpinan-6-yl]iminopropionitrile Formula: C16H17BrN2 MolecularWeight: 317.22358

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1(C2CCCC1C2Br)C3=CC=CC=C3)C#N

Isomeric SMILES

CC(=NC1([C@@H]2CCC[C@H]1C2Br)C3=CC=CC=C3)C#N

InChI

InChI=1S/C16H17BrN2/c1-11(10-18)19-16(12-6-3-2-4-7-12)13-8-5-9-14(16)15(13)17/h2-4,6-7,13-15H,5,8-9H2,1H3/t13-,14+,15?,16?