2-(2-methyl-5-nitro-imidazol-1-yl)ethyl N-[2-(2-nitrooxyethyldisulfanyl)ethyl]carbamate

Systemtic Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl N-[2-(2-nitrooxyethyldisulfanyl)ethyl]carbamate Openeye Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl N-[2-(2-nitrooxyethyldisulfanyl)ethyl]carbamate CAS Name: N-[2-(2-nitrooxyethyldisulfanyl)ethyl]carbamic acid 2-(2-methyl-5-nitro-1-imidazolyl)ethyl ester IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethyl N-[2-(2-nitrooxyethyldisulfanyl)ethyl]carbamate Traditional Name: N-[2-(2-nitrooxyethyldisulfanyl)ethyl]carbamic acid 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl ester Formula: C11H17N5O7S2 MolecularWeight: 395.41198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H17N5O7S2/c1-9-13-8-10(15(18)19)14(9)3-4-22-11(17)12-2-6-24-25-7-5-23-16(20)21/h8H,2-7H2,1H3,(H,12,17)