(1-nitrooxy-3-phenoxy-propan-2-yl) nitrate

Systemtic Name: (1-nitrooxy-3-phenoxy-propan-2-yl) nitrate Openeye Name: [1-(nitrooxymethyl)-2-phenoxy-ethyl] nitrate CAS Name: nitric acid (1-nitrooxy-3-phenoxypropan-2-yl) ester IUPAC Name: (1-nitrooxy-3-phenoxypropan-2-yl) nitrate Traditional Name: nitric acid [1-(nitrooxymethyl)-2-phenoxy-ethyl] ester Formula: C9H10N2O7 MolecularWeight: 258.1849

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10N2O7/c12-10(13)17-7-9(18-11(14)15)6-16-8-4-2-1-3-5-8/h1-5,9H,6-7H2