(4-nitrophenyl)methyl 3-[[2-(3-oxidanylazetidin-1-yl)-1,3-oxazol-4-yl]carbonylamino]pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 3-[[2-(3-oxidanylazetidin-1-yl)-1,3-oxazol-4-yl]carbonylamino]pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 3-[[2-(3-hydroxyazetidin-1-yl)oxazole-4-carbonyl]amino]pyrrolidine-1-carboxylate CAS Name: 3-[[[2-(3-hydroxy-1-azetidinyl)-4-oxazolyl]-oxomethyl]amino]-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-[[2-(3-hydroxyazetidin-1-yl)-1,3-oxazole-4-carbonyl]amino]pyrrolidine-1-carboxylate Traditional Name: 3-[[2-(3-hydroxyazetidin-1-yl)oxazole-4-carbonyl]amino]pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C19H21N5O7 MolecularWeight: 431.39934

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)C2=COC(=N2)N3CC(C3)O)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC1NC(=O)C2=COC(=N2)N3CC(C3)O)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O7/c25-15-8-23(9-15)18-21-16(11-30-18)17(26)20-13-5-6-22(7-13)19(27)31-10-12-1-3-14(4-2-12)24(28)29/h1-4,11,13,15,25H,5-10H2,(H,20,26)