(4-nitrophenyl)methyl 2-(aminomethyl)-2-ethanoyl-4-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-(aminomethyl)-2-ethanoyl-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-acetyl-2-(aminomethyl)-4-hydroxy-pyrrolidine-1-carboxylate CAS Name: 2-acetyl-2-(aminomethyl)-4-hydroxy-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-acetyl-2-(aminomethyl)-4-hydroxypyrrolidine-1-carboxylate Traditional Name: 2-acetyl-2-(aminomethyl)-4-hydroxy-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C15H19N3O6 MolecularWeight: 337.32786

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CC(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O)CN

Isomeric SMILES

CC(=O)C1(CC(CN1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O)CN

InChI

InChI=1S/C15H19N3O6/c1-10(19)15(9-16)6-13(20)7-17(15)14(21)24-8-11-2-4-12(5-3-11)18(22)23/h2-5,13,20H,6-9,16H2,1H3