(4-nitrophenyl)methyl 4-methyl-1,2,5-thiadiazole-3-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 4-methyl-1,2,5-thiadiazole-3-carboxylate Openeye Name: (4-nitrophenyl)methyl 4-methyl-1,2,5-thiadiazole-3-carboxylate CAS Name: 4-methyl-1,2,5-thiadiazole-3-carboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-methyl-1,2,5-thiadiazole-3-carboxylate Traditional Name: 4-methyl-1,2,5-thiadiazole-3-carboxylic acid (4-nitrobenzyl) ester Formula: C11H9N3O4S MolecularWeight: 279.27186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSN=C1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NSN=C1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H9N3O4S/c1-7-10(13-19-12-7)11(15)18-6-8-2-4-9(5-3-8)14(16)17/h2-5H,6H2,1H3