trimethyl (4aS,8aR)-4a,5,8,8a-tetrahydro-1H-isoquinoline-2,4,6-tricarboxylate

Systemtic Name: trimethyl (4aS,8aR)-4a,5,8,8a-tetrahydro-1H-isoquinoline-2,4,6-tricarboxylate Openeye Name: trimethyl (4aS,8aR)-4a,5,8,8a-tetrahydro-1H-isoquinoline-2,4,6-tricarboxylate CAS Name: (4aS,8aR)-4a,5,8,8a-tetrahydro-1H-isoquinoline-2,4,6-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl (4aS,8aR)-4a,5,8,8a-tetrahydro-1H-isoquinoline-2,4,6-tricarboxylate Traditional Name: (4aS,8aR)-4a,5,8,8a-tetrahydro-1H-isoquinoline-2,4,6-tricarboxylic acid trimethyl ester Formula: C15H19NO6 MolecularWeight: 309.31446

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CCC2CN(C=C(C2C1)C(=O)OC)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO6/c1-20-13(17)9-4-5-10-7-16(15(19)22-3)8-12(11(10)6-9)14(18)21-2/h4,8,10-11H,5-7H2,1-3H3/t10-,11-/m0/s1