O2-tert-butyl O1-methyl (1R)-6-(thiophen-2-ylmethoxy)-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate

Systemtic Name: O2-tert-butyl O1-methyl (1R)-6-(thiophen-2-ylmethoxy)-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate Openeye Name: O2-tert-butyl O1-methyl (1R)-6-(2-thienylmethoxy)-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate CAS Name: (1R)-6-(thiophen-2-ylmethoxy)-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylic acid O2-tert-butyl ester O1-methyl ester IUPAC Name: 2-O-tert-butyl 1-O-methyl (1R)-6-(thiophen-2-ylmethoxy)-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylate Traditional Name: (1R)-6-(2-thenyloxy)-3,4-dihydro-1H-isoquinoline-1,2-dicarboxylic acid O2-tert-butyl ester O1-methyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(C1C(=O)OC)C=CC(=C2)OCC3=CC=CS3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C([C@@H]1C(=O)OC)C=CC(=C2)OCC3=CC=CS3

InChI

InChI=1S/C21H25NO5S/c1-21(2,3)27-20(24)22-10-9-14-12-15(26-13-16-6-5-11-28-16)7-8-17(14)18(22)19(23)25-4/h5-8,11-12,18H,9-10,13H2,1-4H3/t18-/m1/s1