5-[(2-chlorophenyl)methyl]-1,2-bis[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 5-[(2-chlorophenyl)methyl]-1,2-bis[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid Openeye Name: 1,2-bis(tert-butoxycarbonyl)-5-[(2-chlorophenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 5-[(2-chlorophenyl)methyl]-1,2-bis[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-[(2-chlorophenyl)methyl]-1,2-bis[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid Traditional Name: 1,2-bis(tert-butoxycarbonyl)-5-(2-chlorobenzyl)proline Formula: C22H30ClNO6 MolecularWeight: 439.9297

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(CCC(N1C(=O)OC(C)(C)C)CC2=CC=CC=C2Cl)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)C1(CCC(N1C(=O)OC(C)(C)C)CC2=CC=CC=C2Cl)C(=O)O

InChI

InChI=1S/C22H30ClNO6/c1-20(2,3)29-18(27)22(17(25)26)12-11-15(13-14-9-7-8-10-16(14)23)24(22)19(28)30-21(4,5)6/h7-10,15H,11-13H2,1-6H3,(H,25,26)