(4-nitrophenyl)methyl 2-(3-oxidanylazetidin-1-yl)-1,3-thiazole-4-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-(3-oxidanylazetidin-1-yl)-1,3-thiazole-4-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(3-hydroxyazetidin-1-yl)thiazole-4-carboxylate CAS Name: 2-(3-hydroxy-1-azetidinyl)-4-thiazolecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(3-hydroxyazetidin-1-yl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(3-hydroxyazetidin-1-yl)thiazole-4-carboxylic acid (4-nitrobenzyl) ester Formula: C14H13N3O5S MolecularWeight: 335.33512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN1C2=NC(=CS2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1C(CN1C2=NC(=CS2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C14H13N3O5S/c18-11-5-16(6-11)14-15-12(8-23-14)13(19)22-7-9-1-3-10(4-2-9)17(20)21/h1-4,8,11,18H,5-7H2