O2-tert-butyl O1-(phenylmethyl) 4-(hydroxymethyl)-4-oxidanyl-pyrazolidine-1,2-dicarboxylate

Systemtic Name: O2-tert-butyl O1-(phenylmethyl) 4-(hydroxymethyl)-4-oxidanyl-pyrazolidine-1,2-dicarboxylate Openeye Name: O1-benzyl O2-tert-butyl 4-hydroxy-4-(hydroxymethyl)pyrazolidine-1,2-dicarboxylate CAS Name: 4-hydroxy-4-(hydroxymethyl)pyrazolidine-1,2-dicarboxylic acid O2-tert-butyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 2-O-tert-butyl 4-hydroxy-4-(hydroxymethyl)pyrazolidine-1,2-dicarboxylate Traditional Name: 4-hydroxy-4-methylol-pyrazolidine-1,2-dicarboxylic acid O1-benzyl ester O2-tert-butyl ester Formula: C17H24N2O6 MolecularWeight: 352.38226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CN1C(=O)OCC2=CC=CC=C2)(CO)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CN1C(=O)OCC2=CC=CC=C2)(CO)O

InChI

InChI=1S/C17H24N2O6/c1-16(2,3)25-15(22)19-11-17(23,12-20)10-18(19)14(21)24-9-13-7-5-4-6-8-13/h4-8,20,23H,9-12H2,1-3H3