[2-(2-nitrooxyethylcarbamoyl)phenyl] 1,3-thiazolidine-4-carboxylate hydrochloride

Systemtic Name: [2-(2-nitrooxyethylcarbamoyl)phenyl] 1,3-thiazolidine-4-carboxylate hydrochloride Openeye Name: [2-(2-nitrooxyethylcarbamoyl)phenyl] thiazolidine-4-carboxylate hydrochloride CAS Name: 4-thiazolidinecarboxylic acid [2-[(2-nitrooxyethylamino)-oxomethyl]phenyl] ester hydrochloride IUPAC Name: [2-(2-nitrooxyethylcarbamoyl)phenyl] 1,3-thiazolidine-4-carboxylate hydrochloride Traditional Name: thiazolidine-4-carboxylic acid [2-(2-nitrooxyethylcarbamoyl)phenyl] ester hydrochloride Formula: C13H16ClN3O6S MolecularWeight: 377.80064

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NCS1)C(=O)OC2=CC=CC=C2C(=O)NCCO[N+](=O)[O-].Cl

Isomeric SMILES

C1C(NCS1)C(=O)OC2=CC=CC=C2C(=O)NCCO[N+](=O)[O-].Cl

InChI

InChI=1S/C13H15N3O6S.ClH/c17-12(14-5-6-21-16(19)20)9-3-1-2-4-11(9)22-13(18)10-7-23-8-15-10;/h1-4,10,15H,5-8H2,(H,14,17);1H