tert-butyl (4aR,8aS)-2-methyl-4a,7,8,8a-tetrahydro-1H-isoquinoline-4-carboxylate

Systemtic Name: tert-butyl (4aR,8aS)-2-methyl-4a,7,8,8a-tetrahydro-1H-isoquinoline-4-carboxylate Openeye Name: tert-butyl (4aR,8aS)-2-methyl-4a,7,8,8a-tetrahydro-1H-isoquinoline-4-carboxylate CAS Name: (4aR,8aS)-2-methyl-4a,7,8,8a-tetrahydro-1H-isoquinoline-4-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4aR,8aS)-2-methyl-4a,7,8,8a-tetrahydro-1H-isoquinoline-4-carboxylate Traditional Name: (4aR,8aS)-2-methyl-4a,7,8,8a-tetrahydro-1H-isoquinoline-4-carboxylic acid tert-butyl ester Formula: C15H23NO2 MolecularWeight: 249.34862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CN(CC2C1C=CCC2)C

Isomeric SMILES

CC(C)(C)OC(=O)C1=CN(C[C@@H]2[C@H]1C=CCC2)C

InChI

InChI=1S/C15H23NO2/c1-15(2,3)18-14(17)13-10-16(4)9-11-7-5-6-8-12(11)13/h6,8,10-12H,5,7,9H2,1-4H3/t11-,12-/m1/s1