O1-tert-butyl O2-methyl (2S,4R)-4-[(8-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)carbonyloxy]pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-methyl (2S,4R)-4-[(8-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)carbonyloxy]pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-methyl (2S,4R)-4-(8-hydroxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)oxypyrrolidine-1,2-dicarboxylate CAS Name: (2S,4R)-4-[(8-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethoxy]pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester IUPAC Name: 1-O-tert-butyl 2-O-methyl (2S,4R)-4-(8-hydroxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)oxypyrrolidine-1,2-dicarboxylate Traditional Name: (2S,4R)-4-(8-hydroxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)oxypyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester Formula: C21H28N2O7 MolecularWeight: 420.45622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)OC)OC(=O)N2CCC3=C(C2)C(=CC=C3)O

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@@H](C[C@H]1C(=O)OC)OC(=O)N2CCC3=C(C2)C(=CC=C3)O

InChI

InChI=1S/C21H28N2O7/c1-21(2,3)30-20(27)23-11-14(10-16(23)18(25)28-4)29-19(26)22-9-8-13-6-5-7-17(24)15(13)12-22/h5-7,14,16,24H,8-12H2,1-4H3/t14-,16+/m1/s1