ethyl 2-cyano-2-[(3S,5R)-3,5-dimethylcyclohexylidene]ethanoate

Systemtic Name: ethyl 2-cyano-2-[(3S,5R)-3,5-dimethylcyclohexylidene]ethanoate Openeye Name: ethyl 2-cyano-2-[(3S,5R)-3,5-dimethylcyclohexylidene]acetate CAS Name: 2-cyano-2-[(3S,5R)-3,5-dimethylcyclohexylidene]acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-[(3S,5R)-3,5-dimethylcyclohexylidene]acetate Traditional Name: 2-cyano-2-[(3S,5R)-3,5-dimethylcyclohexylidene]acetic acid ethyl ester Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1CC(CC(C1)C)C)C#N

Isomeric SMILES

CCOC(=O)C(=C1C[C@@H](C[C@@H](C1)C)C)C#N

InChI

InChI=1S/C13H19NO2/c1-4-16-13(15)12(8-14)11-6-9(2)5-10(3)7-11/h9-10H,4-7H2,1-3H3/t9-,10+