ethyl (2R,4R)-4-(2-nitrooxyethylcarbamoyl)-2-phenyl-1,3-thiazolidine-3-carboxylate

Systemtic Name: ethyl (2R,4R)-4-(2-nitrooxyethylcarbamoyl)-2-phenyl-1,3-thiazolidine-3-carboxylate Openeye Name: ethyl (2R,4R)-4-(2-nitrooxyethylcarbamoyl)-2-phenyl-thiazolidine-3-carboxylate CAS Name: (2R,4R)-4-[(2-nitrooxyethylamino)-oxomethyl]-2-phenyl-3-thiazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2R,4R)-4-(2-nitrooxyethylcarbamoyl)-2-phenyl-1,3-thiazolidine-3-carboxylate Traditional Name: (2R,4R)-4-(2-nitrooxyethylcarbamoyl)-2-phenyl-thiazolidine-3-carboxylic acid ethyl ester Formula: C15H19N3O6S MolecularWeight: 369.39286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(CSC1C2=CC=CC=C2)C(=O)NCCO[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1[C@@H](CS[C@@H]1C2=CC=CC=C2)C(=O)NCCO[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O6S/c1-2-23-15(20)17-12(13(19)16-8-9-24-18(21)22)10-25-14(17)11-6-4-3-5-7-11/h3-7,12,14H,2,8-10H2,1H3,(H,16,19)/t12-,14+/m0/s1