2-[(5-aminocarbonyl-1,3-thiazol-2-yl)carbonyl-(2-nitrooxyethyl)amino]ethyl nitrate

Systemtic Name: 2-[(5-aminocarbonyl-1,3-thiazol-2-yl)carbonyl-(2-nitrooxyethyl)amino]ethyl nitrate Openeye Name: 2-[(5-carbamoylthiazole-2-carbonyl)-(2-nitrooxyethyl)amino]ethyl nitrate CAS Name: nitric acid 2-[[(5-carbamoyl-2-thiazolyl)-oxomethyl]-(2-nitrooxyethyl)amino]ethyl ester IUPAC Name: 2-[(5-carbamoyl-1,3-thiazole-2-carbonyl)-(2-nitrooxyethyl)amino]ethyl nitrate Traditional Name: nitric acid 2-[(5-carbamoylthiazole-2-carbonyl)-(2-nitrooxyethyl)amino]ethyl ester Formula: C9H11N5O8S MolecularWeight: 349.27734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=N1)C(=O)N(CCO[N+](=O)[O-])CCO[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1=C(SC(=N1)C(=O)N(CCO[N+](=O)[O-])CCO[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C9H11N5O8S/c10-7(15)6-5-11-8(23-6)9(16)12(1-3-21-13(17)18)2-4-22-14(19)20/h5H,1-4H2,(H2,10,15)