(1S,4S)-5-chloranyl-1,4-dimethyl-bicyclo[2.2.2]oct-2-ene-5-carbonitrile

Systemtic Name: (1S,4S)-5-chloranyl-1,4-dimethyl-bicyclo[2.2.2]oct-2-ene-5-carbonitrile Openeye Name: (1S,4S)-5-chloro-1,4-dimethyl-bicyclo[2.2.2]oct-2-ene-5-carbonitrile CAS Name: (1S,4S)-5-chloro-1,4-dimethyl-5-bicyclo[2.2.2]oct-2-enecarbonitrile IUPAC Name: (1S,4S)-5-chloro-1,4-dimethylbicyclo[2.2.2]oct-2-ene-5-carbonitrile Traditional Name: (1S,4S)-5-chloro-1,4-dimethyl-bicyclo[2.2.2]oct-2-ene-5-carbonitrile Formula: C11H14ClN MolecularWeight: 195.68856

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(C=C1)(C(C2)(C#N)Cl)C

Isomeric SMILES

C[C@@]12CC[C@@](C=C1)(C(C2)(C#N)Cl)C

InChI

InChI=1S/C11H14ClN/c1-9-3-5-10(2,6-4-9)11(12,7-9)8-13/h3,5H,4,6-7H2,1-2H3/t9-,10+,11?/m0/s1