ethyl 2-[1-[[2-(2-nitrooxyethyldisulfanyl)ethoxycarbonylamino]methyl]cyclohexyl]ethanoate

Systemtic Name: ethyl 2-[1-[[2-(2-nitrooxyethyldisulfanyl)ethoxycarbonylamino]methyl]cyclohexyl]ethanoate Openeye Name: ethyl 2-[1-[[2-(2-nitrooxyethyldisulfanyl)ethoxycarbonylamino]methyl]cyclohexyl]acetate CAS Name: 2-[1-[[[2-(2-nitrooxyethyldisulfanyl)ethoxy-oxomethyl]amino]methyl]cyclohexyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[[2-(2-nitrooxyethyldisulfanyl)ethoxycarbonylamino]methyl]cyclohexyl]acetate Traditional Name: 2-[1-[[2-(2-nitrooxyethyldisulfanyl)ethoxycarbonylamino]methyl]cyclohexyl]acetic acid ethyl ester Formula: C16H28N2O7S2 MolecularWeight: 424.53272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1(CCCCC1)CNC(=O)OCCSSCCO[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC1(CCCCC1)CNC(=O)OCCSSCCO[N+](=O)[O-]

InChI

InChI=1S/C16H28N2O7S2/c1-2-23-14(19)12-16(6-4-3-5-7-16)13-17-15(20)24-8-10-26-27-11-9-25-18(21)22/h2-13H2,1H3,(H,17,20)