(1-nitro-3-phenyl-propan-2-yl) nitrate

Systemtic Name: (1-nitro-3-phenyl-propan-2-yl) nitrate Openeye Name: (1-benzyl-2-nitro-ethyl) nitrate CAS Name: nitric acid (1-nitro-3-phenylpropan-2-yl) ester IUPAC Name: (1-nitro-3-phenylpropan-2-yl) nitrate Traditional Name: nitric acid (1-benzyl-2-nitro-ethyl) ester Formula: C9H10N2O5 MolecularWeight: 226.1861

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10N2O5/c12-10(13)7-9(16-11(14)15)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2