tert-butyl 2-acetyloxy-2-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-4-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-acetyloxy-2-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-acetoxy-4-hydroxy-2-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]pyrrolidine-1-carboxylate CAS Name: 2-acetyloxy-4-hydroxy-2-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-acetyloxy-4-hydroxy-2-[[4-[4-(hydroxymethyl)phenyl]phenyl]methyl]pyrrolidine-1-carboxylate Traditional Name: 2-acetoxy-4-hydroxy-2-[4-(4-methylolphenyl)benzyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C25H31NO6 MolecularWeight: 441.51674

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(CC(CN1C(=O)OC(C)(C)C)O)CC2=CC=C(C=C2)C3=CC=C(C=C3)CO

Isomeric SMILES

CC(=O)OC1(CC(CN1C(=O)OC(C)(C)C)O)CC2=CC=C(C=C2)C3=CC=C(C=C3)CO

InChI

InChI=1S/C25H31NO6/c1-17(28)31-25(14-22(29)15-26(25)23(30)32-24(2,3)4)13-18-5-9-20(10-6-18)21-11-7-19(16-27)8-12-21/h5-12,22,27,29H,13-16H2,1-4H3