ethyl (6S,8aS)-8a-methyl-6-oxidanyl-1,3,4,6,7,8-hexahydroisoquinoline-2-carboxylate

Systemtic Name: ethyl (6S,8aS)-8a-methyl-6-oxidanyl-1,3,4,6,7,8-hexahydroisoquinoline-2-carboxylate Openeye Name: ethyl (6S,8aS)-6-hydroxy-8a-methyl-1,3,4,6,7,8-hexahydroisoquinoline-2-carboxylate CAS Name: (6S,8aS)-6-hydroxy-8a-methyl-1,3,4,6,7,8-hexahydroisoquinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl (6S,8aS)-6-hydroxy-8a-methyl-1,3,4,6,7,8-hexahydroisoquinoline-2-carboxylate Traditional Name: (6S,8aS)-6-hydroxy-8a-methyl-1,3,4,6,7,8-hexahydroisoquinoline-2-carboxylic acid ethyl ester Formula: C13H21NO3 MolecularWeight: 239.31074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC2=CC(CCC2(C1)C)O

Isomeric SMILES

CCOC(=O)N1CCC2=C[C@H](CC[C@@]2(C1)C)O

InChI

InChI=1S/C13H21NO3/c1-3-17-12(16)14-7-5-10-8-11(15)4-6-13(10,2)9-14/h8,11,15H,3-7,9H2,1-2H3/t11-,13+/m0/s1