methyl 2-cyano-2-[(1R,5S)-3-cyano-2-methylsulfanyl-4-oxidanylidene-9-bicyclo[3.3.1]non-2-enylidene]ethanoate

Systemtic Name: methyl 2-cyano-2-[(1R,5S)-3-cyano-2-methylsulfanyl-4-oxidanylidene-9-bicyclo[3.3.1]non-2-enylidene]ethanoate Openeye Name: methyl 2-cyano-2-[(1R,5S)-3-cyano-2-methylsulfanyl-4-oxo-9-bicyclo[3.3.1]non-2-enylidene]acetate CAS Name: 2-cyano-2-[(1R,5S)-3-cyano-2-(methylthio)-4-oxo-9-bicyclo[3.3.1]non-2-enylidene]acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-[(1R,5S)-3-cyano-2-methylsulfanyl-4-oxo-9-bicyclo[3.3.1]non-2-enylidene]acetate Traditional Name: 2-cyano-2-[(1R,5S)-3-cyano-4-keto-2-(methylthio)-9-bicyclo[3.3.1]non-2-enylidene]acetic acid methyl ester Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C1C2CCCC1C(=O)C(=C2SC)C#N)C#N

Isomeric SMILES

COC(=O)C(=C1[C@H]2CCC[C@@H]1C(=O)C(=C2SC)C#N)C#N

InChI

InChI=1S/C15H14N2O3S/c1-20-15(19)10(6-16)12-8-4-3-5-9(12)14(21-2)11(7-17)13(8)18/h8-9H,3-5H2,1-2H3/t8-,9+/m0/s1