O1-tert-butyl O2-ethyl (2S,3R)-3-(4-chlorophenyl)pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-ethyl (2S,3R)-3-(4-chlorophenyl)pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-ethyl (2S,3R)-3-(4-chlorophenyl)pyrrolidine-1,2-dicarboxylate CAS Name: (2S,3R)-3-(4-chlorophenyl)pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-ethyl ester IUPAC Name: 1-O-tert-butyl 2-O-ethyl (2S,3R)-3-(4-chlorophenyl)pyrrolidine-1,2-dicarboxylate Traditional Name: (2S,3R)-3-(4-chlorophenyl)pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-ethyl ester Formula: C18H24ClNO4 MolecularWeight: 353.84046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CCN1C(=O)OC(C)(C)C)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H](CCN1C(=O)OC(C)(C)C)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H24ClNO4/c1-5-23-16(21)15-14(12-6-8-13(19)9-7-12)10-11-20(15)17(22)24-18(2,3)4/h6-9,14-15H,5,10-11H2,1-4H3/t14-,15+/m1/s1