[(3S,3aR,6S,6aS)-3-[2-[[(4R)-1,3-thiazolidin-3-ium-4-yl]carbonylamino]ethanoylamino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate chloride

Systemtic Name: [(3S,3aR,6S,6aS)-3-[2-[[(4R)-1,3-thiazolidin-3-ium-4-yl]carbonylamino]ethanoylamino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate chloride Openeye Name: [(3S,3aR,6S,6aS)-3-[[2-[[(4R)-thiazolidin-3-ium-4-carbonyl]amino]acetyl]amino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate chloride CAS Name: nitric acid [(3S,3aR,6S,6aS)-3-[[1-oxo-2-[[oxo-[(4R)-4-thiazolidin-3-iumyl]methyl]amino]ethyl]amino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] ester chloride IUPAC Name: [(3S,3aR,6S,6aS)-3-[[2-[[(4R)-1,3-thiazolidin-3-ium-4-carbonyl]amino]acetyl]amino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate chloride Traditional Name: nitric acid [(3S,3aR,6S,6aS)-3-[[2-[[(4R)-thiazolidin-3-ium-4-carbonyl]amino]acetyl]amino]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] ester chloride Formula: C12H19ClN4O7S MolecularWeight: 398.81986

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2C(O1)C(CO2)O[N+](=O)[O-])NC(=O)CNC(=O)C3CSC[NH2+]3.[Cl-]

Isomeric SMILES

C1[C@@H]([C@@H]2[C@H](O1)[C@H](CO2)O[N+](=O)[O-])NC(=O)CNC(=O)[C@@H]3CSC[NH2+]3.[Cl-]

InChI

InChI=1S/C12H18N4O7S.ClH/c17-9(1-13-12(18)7-4-24-5-14-7)15-6-2-21-11-8(23-16(19)20)3-22-10(6)11;/h6-8,10-11,14H,1-5H2,(H,13,18)(H,15,17);1H/t6-,7-,8-,10+,11+;/m0./s1