[3-(2,4-dinitrophenoxy)-2-oxidanyl-propyl]phosphonic acid

Systemtic Name: [3-(2,4-dinitrophenoxy)-2-oxidanyl-propyl]phosphonic acid Openeye Name: [3-(2,4-dinitrophenoxy)-2-hydroxy-propyl]phosphonic acid CAS Name: [3-(2,4-dinitrophenoxy)-2-hydroxypropyl]phosphonic acid IUPAC Name: [3-(2,4-dinitrophenoxy)-2-hydroxypropyl]phosphonic acid Traditional Name: [3-(2,4-dinitrophenoxy)-2-hydroxy-propyl]phosphonic acid Formula: C9H11N2O9P MolecularWeight: 322.165401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11N2O9P/c12-7(5-21(17,18)19)4-20-9-2-1-6(10(13)14)3-8(9)11(15)16/h1-3,7,12H,4-5H2,(H2,17,18,19)