2,3-bis(oxidanyl)propyl 2,4-dinitrobenzoate

Systemtic Name: 2,3-bis(oxidanyl)propyl 2,4-dinitrobenzoate Openeye Name: 2,3-dihydroxypropyl 2,4-dinitrobenzoate CAS Name: 2,4-dinitrobenzoic acid 2,3-dihydroxypropyl ester IUPAC Name: 2,3-dihydroxypropyl 2,4-dinitrobenzoate Traditional Name: 2,4-dinitrobenzoic acid glyceryl ester Formula: C10H10N2O8 MolecularWeight: 286.195

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10N2O8/c13-4-7(14)5-20-10(15)8-2-1-6(11(16)17)3-9(8)12(18)19/h1-3,7,13-14H,4-5H2