4-(2,3-dinitrooxypropoxy)benzoic acid

Systemtic Name: 4-(2,3-dinitrooxypropoxy)benzoic acid Openeye Name: 4-(2,3-dinitrooxypropoxy)benzoic acid CAS Name: 4-(2,3-dinitrooxypropoxy)benzoic acid IUPAC Name: 4-(2,3-dinitrooxypropoxy)benzoic acid Traditional Name: 4-(2,3-dinitrooxypropoxy)benzoic acid Formula: C10H10N2O9 MolecularWeight: 302.1944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)OCC(CO[N+](=O)[O-])O[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)OCC(CO[N+](=O)[O-])O[N+](=O)[O-]

InChI

InChI=1S/C10H10N2O9/c13-10(14)7-1-3-8(4-2-7)19-5-9(21-12(17)18)6-20-11(15)16/h1-4,9H,5-6H2,(H,13,14)