ethyl 6-tert-butyl-3-oxidanylidene-1,2,4,4a,5,6,7,8-octahydroisoquinoline-8a-carboxylate

Systemtic Name: ethyl 6-tert-butyl-3-oxidanylidene-1,2,4,4a,5,6,7,8-octahydroisoquinoline-8a-carboxylate Openeye Name: ethyl 6-tert-butyl-3-oxo-1,2,4,4a,5,6,7,8-octahydroisoquinoline-8a-carboxylate CAS Name: 6-tert-butyl-3-oxo-1,2,4,4a,5,6,7,8-octahydroisoquinoline-8a-carboxylic acid ethyl ester IUPAC Name: ethyl 6-tert-butyl-3-oxo-1,2,4,4a,5,6,7,8-octahydroisoquinoline-8a-carboxylate Traditional Name: 6-tert-butyl-3-keto-1,2,4,4a,5,6,7,8-octahydroisoquinoline-8a-carboxylic acid ethyl ester Formula: C16H27NO3 MolecularWeight: 281.39048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C12CCC(CC1CC(=O)NC2)C(C)(C)C

Isomeric SMILES

CCOC(=O)C12CCC(CC1CC(=O)NC2)C(C)(C)C

InChI

InChI=1S/C16H27NO3/c1-5-20-14(19)16-7-6-11(15(2,3)4)8-12(16)9-13(18)17-10-16/h11-12H,5-10H2,1-4H3,(H,17,18)