ethyl (8R,8aS)-8-cyano-6-oxidanylidene-7,8a,9,10,11,12-hexahydrochromeno[3,4-c]quinolizine-8-carboxylate

Systemtic Name: ethyl (8R,8aS)-8-cyano-6-oxidanylidene-7,8a,9,10,11,12-hexahydrochromeno[3,4-c]quinolizine-8-carboxylate Openeye Name: ethyl (8R,8aS)-8-cyano-6-oxo-7,8a,9,10,11,12-hexahydrochromeno[3,4-c]quinolizine-8-carboxylate CAS Name: (8R,8aS)-8-cyano-6-oxo-7,8a,9,10,11,12-hexahydro[1]benzopyrano[3,4-c]quinolizine-8-carboxylic acid ethyl ester IUPAC Name: ethyl (8R,8aS)-8-cyano-6-oxo-7,8a,9,10,11,12-hexahydrochromeno[3,4-c]quinolizine-8-carboxylate Traditional Name: (8R,8aS)-8-cyano-6-keto-7,8a,9,10,11,12-hexahydrochromeno[3,4-c]quinolizine-8-carboxylic acid ethyl ester Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC2=C(C3=CC=CC=C3OC2=O)N4C1CCCC4)C#N

Isomeric SMILES

CCOC(=O)[C@@]1(CC2=C(C3=CC=CC=C3OC2=O)N4[C@H]1CCCC4)C#N

InChI

InChI=1S/C20H20N2O4/c1-2-25-19(24)20(12-21)11-14-17(22-10-6-5-9-16(20)22)13-7-3-4-8-15(13)26-18(14)23/h3-4,7-8,16H,2,5-6,9-11H2,1H3/t16-,20-/m0/s1