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

Systemtic Name: methyl (4aR,8aS)-2-methyl-4a,7,8,8a-tetrahydro-1H-isoquinoline-4-carboxylate Openeye Name: methyl (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 methyl ester IUPAC Name: methyl (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 methyl ester Formula: C12H17NO2 MolecularWeight: 207.26888

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2CCC=CC2C(=C1)C(=O)OC

Isomeric SMILES

CN1C[C@H]2CCC=C[C@H]2C(=C1)C(=O)OC

InChI

InChI=1S/C12H17NO2/c1-13-7-9-5-3-4-6-10(9)11(8-13)12(14)15-2/h4,6,8-10H,3,5,7H2,1-2H3/t9-,10-/m1/s1