(1-nitro-3-phenylmethoxy-propan-2-yl) ethanoate

Systemtic Name: (1-nitro-3-phenylmethoxy-propan-2-yl) ethanoate Openeye Name: [1-(benzyloxymethyl)-2-nitro-ethyl] acetate CAS Name: acetic acid (1-nitro-3-phenylmethoxypropan-2-yl) ester IUPAC Name: (1-nitro-3-phenylmethoxypropan-2-yl) acetate Traditional Name: acetic acid [1-(benzoxymethyl)-2-nitro-ethyl] ester Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C[N+](=O)[O-])COCC1=CC=CC=C1

Isomeric SMILES

CC(=O)OC(C[N+](=O)[O-])COCC1=CC=CC=C1

InChI

InChI=1S/C12H15NO5/c1-10(14)18-12(7-13(15)16)9-17-8-11-5-3-2-4-6-11/h2-6,12H,7-9H2,1H3