2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 2-(2-nitrooxyethyldisulfanyl)ethyl carbonate

Systemtic Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 2-(2-nitrooxyethyldisulfanyl)ethyl carbonate Openeye Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 2-(2-nitrooxyethyldisulfanyl)ethyl carbonate CAS Name: carbonic acid 2-(2-methyl-5-nitro-1-imidazolyl)ethyl 2-(2-nitrooxyethyldisulfanyl)ethyl ester IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethyl 2-(2-nitrooxyethyldisulfanyl)ethyl carbonate Traditional Name: carbonic acid 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 2-(2-nitrooxyethyldisulfanyl)ethyl ester Formula: C11H16N4O8S2 MolecularWeight: 396.39674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCOC(=O)OCCSSCCO[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCOC(=O)OCCSSCCO[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H16N4O8S2/c1-9-12-8-10(14(17)18)13(9)2-3-21-11(16)22-4-6-24-25-7-5-23-15(19)20/h8H,2-7H2,1H3