2-(3-ethoxy-5-nitro-4-oxidanyl-phenyl)-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 2-(3-ethoxy-5-nitro-4-oxidanyl-phenyl)-1,3-thiazolidine-4-carboxylic acid Openeye Name: 2-(3-ethoxy-4-hydroxy-5-nitro-phenyl)thiazolidine-4-carboxylic acid CAS Name: 2-(3-ethoxy-4-hydroxy-5-nitrophenyl)-4-thiazolidinecarboxylic acid IUPAC Name: 2-(3-ethoxy-4-hydroxy-5-nitrophenyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 2-(3-ethoxy-4-hydroxy-5-nitro-phenyl)thiazolidine-4-carboxylic acid Formula: C12H14N2O6S MolecularWeight: 314.31436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C2NC(CS2)C(=O)O

Isomeric SMILES

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C2NC(CS2)C(=O)O

InChI

InChI=1S/C12H14N2O6S/c1-2-20-9-4-6(3-8(10(9)15)14(18)19)11-13-7(5-21-11)12(16)17/h3-4,7,11,13,15H,2,5H2,1H3,(H,16,17)