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

Systemtic Name: (4-nitrophenyl)methyl 2-(4-methylsulfonyloxypiperidin-1-yl)-1,3-thiazole-4-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(4-methylsulfonyloxy-1-piperidyl)thiazole-4-carboxylate CAS Name: 2-(4-methylsulfonyloxy-1-piperidinyl)-4-thiazolecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(4-methylsulfonyloxypiperidin-1-yl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(4-methylsulfonyloxypiperidino)thiazole-4-carboxylic acid (4-nitrobenzyl) ester Formula: C17H19N3O7S2 MolecularWeight: 441.47866

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CCN(CC1)C2=NC(=CS2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)OC1CCN(CC1)C2=NC(=CS2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O7S2/c1-29(24,25)27-14-6-8-19(9-7-14)17-18-15(11-28-17)16(21)26-10-12-2-4-13(5-3-12)20(22)23/h2-5,11,14H,6-10H2,1H3