1-(2-methoxy-4,5-dinitro-phenoxy)hexan-1-ol

Systemtic Name: 1-(2-methoxy-4,5-dinitro-phenoxy)hexan-1-ol Openeye Name: 1-(2-methoxy-4,5-dinitro-phenoxy)hexan-1-ol CAS Name: 1-(2-methoxy-4,5-dinitrophenoxy)-1-hexanol IUPAC Name: 1-(2-methoxy-4,5-dinitrophenoxy)hexan-1-ol Traditional Name: 1-(2-methoxy-4,5-dinitro-phenoxy)hexan-1-ol Formula: C13H18N2O7 MolecularWeight: 314.29122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(O)OC1=C(C=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-])OC

Isomeric SMILES

CCCCCC(O)OC1=C(C=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-])OC

InChI

InChI=1S/C13H18N2O7/c1-3-4-5-6-13(16)22-12-8-10(15(19)20)9(14(17)18)7-11(12)21-2/h7-8,13,16H,3-6H2,1-2H3