methyl (2R,3S)-3-cyano-2,3,5,6,7,8-hexahydronaphthalene-2-carboxylate

Systemtic Name: methyl (2R,3S)-3-cyano-2,3,5,6,7,8-hexahydronaphthalene-2-carboxylate Openeye Name: methyl (2R,3S)-3-cyano-2,3,5,6,7,8-hexahydronaphthalene-2-carboxylate CAS Name: (2R,3S)-3-cyano-2,3,5,6,7,8-hexahydronaphthalene-2-carboxylic acid methyl ester IUPAC Name: methyl (2R,3S)-3-cyano-2,3,5,6,7,8-hexahydronaphthalene-2-carboxylate Traditional Name: (2R,3S)-3-cyano-2,3,5,6,7,8-hexahydronaphthalene-2-carboxylic acid methyl ester Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C=C2CCCCC2=CC1C#N

Isomeric SMILES

COC(=O)[C@@H]1C=C2CCCCC2=C[C@@H]1C#N

InChI

InChI=1S/C13H15NO2/c1-16-13(15)12-7-10-5-3-2-4-9(10)6-11(12)8-14/h6-7,11-12H,2-5H2,1H3/t11-,12-/m1/s1