2-[2-(2-nitrooxyethyl)phenyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 2-[2-(2-nitrooxyethyl)phenyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 2-[2-(2-nitrooxyethyl)phenyl]thiazolidine-4-carboxylic acid CAS Name: 2-[2-(2-nitrooxyethyl)phenyl]-4-thiazolidinecarboxylic acid IUPAC Name: 2-[2-(2-nitrooxyethyl)phenyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 2-[2-(2-nitrooxyethyl)phenyl]thiazolidine-4-carboxylic acid Formula: C12H14N2O5S MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(S1)C2=CC=CC=C2CCO[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1C(NC(S1)C2=CC=CC=C2CCO[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C12H14N2O5S/c15-12(16)10-7-20-11(13-10)9-4-2-1-3-8(9)5-6-19-14(17)18/h1-4,10-11,13H,5-7H2,(H,15,16)