3,5-dinitro-N-octadecyl-pyridin-2-amine

Systemtic Name: 3,5-dinitro-N-octadecyl-pyridin-2-amine Openeye Name: 3,5-dinitro-N-octadecyl-pyridin-2-amine CAS Name: 3,5-dinitro-N-octadecyl-2-pyridinamine IUPAC Name: 3,5-dinitro-N-octadecylpyridin-2-amine Traditional Name: (3,5-dinitro-2-pyridyl)-stearyl-amine Formula: C23H40N4O4 MolecularWeight: 436.5881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC1=C(C=C(C=N1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC1=C(C=C(C=N1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H40N4O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-23-22(27(30)31)19-21(20-25-23)26(28)29/h19-20H,2-18H2,1H3,(H,24,25)