2-dipropoxyphosphoryl-1,3-dinitro-5-(trifluoromethyl)benzene

Systemtic Name: 2-dipropoxyphosphoryl-1,3-dinitro-5-(trifluoromethyl)benzene Openeye Name: 2-dipropoxyphosphoryl-1,3-dinitro-5-(trifluoromethyl)benzene CAS Name: 2-dipropoxyphosphoryl-1,3-dinitro-5-(trifluoromethyl)benzene IUPAC Name: 2-dipropoxyphosphoryl-1,3-dinitro-5-(trifluoromethyl)benzene Traditional Name: 2-dipropoxyphosphoryl-1,3-dinitro-5-(trifluoromethyl)benzene Formula: C13H16F3N2O7P MolecularWeight: 400.244311

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Descriptors Computed from Structure

Canonical SMILES:

CCCOP(=O)(C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])OCCC

Isomeric SMILES

CCCOP(=O)(C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])OCCC

InChI

InChI=1S/C13H16F3N2O7P/c1-3-5-24-26(23,25-6-4-2)12-10(17(19)20)7-9(13(14,15)16)8-11(12)18(21)22/h7-8H,3-6H2,1-2H3