5-[1-[(2-methylpropan-2-yl)oxy]-1-oxidanylidene-pentan-2-yl]-2-oxidanyl-1-(phenylmethyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 5-[1-[(2-methylpropan-2-yl)oxy]-1-oxidanylidene-pentan-2-yl]-2-oxidanyl-1-(phenylmethyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-benzyl-5-(1-tert-butoxycarbonylbutyl)-2-hydroxy-pyrrolidine-2-carboxylic acid CAS Name: 2-hydroxy-5-[1-[(2-methylpropan-2-yl)oxy]-1-oxopentan-2-yl]-1-(phenylmethyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-benzyl-2-hydroxy-5-[1-[(2-methylpropan-2-yl)oxy]-1-oxopentan-2-yl]pyrrolidine-2-carboxylic acid Traditional Name: 1-benzyl-5-(1-tert-butoxycarbonylbutyl)-2-hydroxy-proline Formula: C21H31NO5 MolecularWeight: 377.47454

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1CCC(N1CC2=CC=CC=C2)(C(=O)O)O)C(=O)OC(C)(C)C

Isomeric SMILES

CCCC(C1CCC(N1CC2=CC=CC=C2)(C(=O)O)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H31NO5/c1-5-9-16(18(23)27-20(2,3)4)17-12-13-21(26,19(24)25)22(17)14-15-10-7-6-8-11-15/h6-8,10-11,16-17,26H,5,9,12-14H2,1-4H3,(H,24,25)