methyl 3-[(2-nitrophenyl)methylsulfonyl]-1,3-thiazolidine-2-carboxylate

Systemtic Name: methyl 3-[(2-nitrophenyl)methylsulfonyl]-1,3-thiazolidine-2-carboxylate Openeye Name: methyl 3-[(2-nitrophenyl)methylsulfonyl]thiazolidine-2-carboxylate CAS Name: 3-[(2-nitrophenyl)methylsulfonyl]-2-thiazolidinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-nitrophenyl)methylsulfonyl]-1,3-thiazolidine-2-carboxylate Traditional Name: 3-(2-nitrobenzyl)sulfonylthiazolidine-2-carboxylic acid methyl ester Formula: C12H14N2O6S2 MolecularWeight: 346.37936

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1N(CCS1)S(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1N(CCS1)S(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O6S2/c1-20-12(15)11-13(6-7-21-11)22(18,19)8-9-4-2-3-5-10(9)14(16)17/h2-5,11H,6-8H2,1H3