1-[6-(2-nitrooxyundecylamino)hexylamino]undecan-2-yl nitrate

Systemtic Name: 1-[6-(2-nitrooxyundecylamino)hexylamino]undecan-2-yl nitrate Openeye Name: 1-[[6-(2-nitrooxyundecylamino)hexylamino]methyl]decyl nitrate CAS Name: nitric acid 1-[6-(2-nitrooxyundecylamino)hexylamino]undecan-2-yl ester IUPAC Name: 1-[6-(2-nitrooxyundecylamino)hexylamino]undecan-2-yl nitrate Traditional Name: nitric acid 1-[[6-(2-nitrooxyundecylamino)hexylamino]methyl]decyl ester Formula: C28H58N4O6 MolecularWeight: 546.78332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CNCCCCCCNCC(CCCCCCCCC)O[N+](=O)[O-])O[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCC(CNCCCCCCNCC(CCCCCCCCC)O[N+](=O)[O-])O[N+](=O)[O-]

InChI

InChI=1S/C28H58N4O6/c1-3-5-7-9-11-13-17-21-27(37-31(33)34)25-29-23-19-15-16-20-24-30-26-28(38-32(35)36)22-18-14-12-10-8-6-4-2/h27-30H,3-26H2,1-2H3