(3,5-dinitro-2-propanoyloxy-phenyl) propanoate

Systemtic Name: (3,5-dinitro-2-propanoyloxy-phenyl) propanoate Openeye Name: (3,5-dinitro-2-propanoyloxy-phenyl) propanoate CAS Name: propanoic acid [3,5-dinitro-2-(1-oxopropoxy)phenyl] ester IUPAC Name: (3,5-dinitro-2-propanoyloxyphenyl) propanoate Traditional Name: propionic acid (3,5-dinitro-2-propionyloxy-phenyl) ester Formula: C12H12N2O8 MolecularWeight: 312.23228

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC(=CC(=C1OC(=O)CC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC(=O)OC1=CC(=CC(=C1OC(=O)CC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H12N2O8/c1-3-10(15)21-9-6-7(13(17)18)5-8(14(19)20)12(9)22-11(16)4-2/h5-6H,3-4H2,1-2H3