O1-tert-butyl O2-methyl (2R,3R)-3-(1,3-benzodioxol-5-yl)pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-methyl (2R,3R)-3-(1,3-benzodioxol-5-yl)pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-methyl (2R,3R)-3-(1,3-benzodioxol-5-yl)pyrrolidine-1,2-dicarboxylate CAS Name: (2R,3R)-3-(1,3-benzodioxol-5-yl)pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester IUPAC Name: 1-O-tert-butyl 2-O-methyl (2R,3R)-3-(1,3-benzodioxol-5-yl)pyrrolidine-1,2-dicarboxylate Traditional Name: (2R,3R)-3-(1,3-benzodioxol-5-yl)pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester Formula: C18H23NO6 MolecularWeight: 349.37832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1C(=O)OC)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[C@@H]([C@@H]1C(=O)OC)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H23NO6/c1-18(2,3)25-17(21)19-8-7-12(15(19)16(20)22-4)11-5-6-13-14(9-11)24-10-23-13/h5-6,9,12,15H,7-8,10H2,1-4H3/t12-,15-/m1/s1