(4-nitrophenyl)methyl 2-[[4-(hydroxymethyl)phenyl]-oxidanyl-methyl]-4-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-[[4-(hydroxymethyl)phenyl]-oxidanyl-methyl]-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-hydroxy-2-[hydroxy-[4-(hydroxymethyl)phenyl]methyl]pyrrolidine-1-carboxylate CAS Name: 4-hydroxy-2-[hydroxy-[4-(hydroxymethyl)phenyl]methyl]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-hydroxy-2-[hydroxy-[4-(hydroxymethyl)phenyl]methyl]pyrrolidine-1-carboxylate Traditional Name: 4-hydroxy-2-[hydroxy-(4-methylolphenyl)methyl]pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C20H22N2O7 MolecularWeight: 402.39788

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(C2=CC=C(C=C2)CO)O)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1C(CN(C1C(C2=CC=C(C=C2)CO)O)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C20H22N2O7/c23-11-13-1-5-15(6-2-13)19(25)18-9-17(24)10-21(18)20(26)29-12-14-3-7-16(8-4-14)22(27)28/h1-8,17-19,23-25H,9-12H2