methyl (4aR,8aS)-8a-cyano-1,2,3,4,5,8-hexahydronaphthalene-4a-carboxylate

Systemtic Name: methyl (4aR,8aS)-8a-cyano-1,2,3,4,5,8-hexahydronaphthalene-4a-carboxylate Openeye Name: methyl (4aR,8aS)-8a-cyano-1,2,3,4,5,8-hexahydronaphthalene-4a-carboxylate CAS Name: (4aR,8aS)-8a-cyano-1,2,3,4,5,8-hexahydronaphthalene-4a-carboxylic acid methyl ester IUPAC Name: methyl (4aR,8aS)-8a-cyano-1,2,3,4,5,8-hexahydronaphthalene-4a-carboxylate Traditional Name: (4aR,8aS)-8a-cyano-1,2,3,4,5,8-hexahydronaphthalene-4a-carboxylic acid methyl ester Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C12CCCCC1(CC=CC2)C#N

Isomeric SMILES

COC(=O)[C@@]12CCCC[C@@]1(CC=CC2)C#N

InChI

InChI=1S/C13H17NO2/c1-16-11(15)13-8-4-2-6-12(13,10-14)7-3-5-9-13/h2,4H,3,5-9H2,1H3/t12-,13+/m0/s1