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2,4,6-trinitro-3-propyl-phenol

2,4,6-trinitro-3-propyl-phenol

Systemtic Name:2,4,6-trinitro-3-propyl-phenol
Openeye Name:2,4,6-trinitro-3-propyl-phenol
CAS Name:2,4,6-trinitro-3-propylphenol
IUPAC Name:2,4,6-trinitro-3-propylphenol
Traditional Name:2,4,6-trinitro-3-propyl-phenol
Formula: C9H9N3O7
MolecularWeight: 271.18366
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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])O)[N+](=O)[O-]


Isomeric SMILES

CCCC1=C(C(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])O)[N+](=O)[O-]


InChI

InChI=1S/C9H9N3O7/c1-2-3-5-6(10(14)15)4-7(11(16)17)9(13)8(5)12(18)19/h4,13H,2-3H2,1H3


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