3-(2,4-dinitrophenoxy)-2-phosphonato-propan-1-ol

Systemtic Name: 3-(2,4-dinitrophenoxy)-2-phosphonato-propan-1-ol Openeye Name: 3-(2,4-dinitrophenoxy)-2-phosphonato-propan-1-ol CAS Name: 3-(2,4-dinitrophenoxy)-2-phosphonato-1-propanol IUPAC Name: 3-(2,4-dinitrophenoxy)-2-phosphonatopropan-1-ol Traditional Name: 3-(2,4-dinitrophenoxy)-2-phosphonato-propan-1-ol Formula: C9H9N2O9P-2 MolecularWeight: 320.149521

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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