2-[5-chloranyl-2-(2-nitrooxyethoxy)phenyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 2-[5-chloranyl-2-(2-nitrooxyethoxy)phenyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 2-[5-chloro-2-(2-nitrooxyethoxy)phenyl]thiazolidine-4-carboxylic acid CAS Name: 2-[5-chloro-2-(2-nitrooxyethoxy)phenyl]-4-thiazolidinecarboxylic acid IUPAC Name: 2-[5-chloro-2-(2-nitrooxyethoxy)phenyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 2-[5-chloro-2-(2-nitrooxyethoxy)phenyl]thiazolidine-4-carboxylic acid Formula: C12H13ClN2O6S MolecularWeight: 348.75942

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(S1)C2=C(C=CC(=C2)Cl)OCCO[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1C(NC(S1)C2=C(C=CC(=C2)Cl)OCCO[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C12H13ClN2O6S/c13-7-1-2-10(20-3-4-21-15(18)19)8(5-7)11-14-9(6-22-11)12(16)17/h1-2,5,9,11,14H,3-4,6H2,(H,16,17)