3-[(4-nitrophenyl)methylsulfonyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-[(4-nitrophenyl)methylsulfonyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-[(4-nitrophenyl)methylsulfonyl]thiazolidine-4-carboxylic acid CAS Name: 3-[(4-nitrophenyl)methylsulfonyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-[(4-nitrophenyl)methylsulfonyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-(4-nitrobenzyl)sulfonylthiazolidine-4-carboxylic acid Formula: C11H12N2O6S2 MolecularWeight: 332.35278

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CS1)S(=O)(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1C(N(CS1)S(=O)(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H12N2O6S2/c14-11(15)10-5-20-7-12(10)21(18,19)6-8-1-3-9(4-2-8)13(16)17/h1-4,10H,5-7H2,(H,14,15)