[(2R)-2-(hydroxymethyl)-2-nitro-3-phenyl-propyl] ethanoate

Systemtic Name: [(2R)-2-(hydroxymethyl)-2-nitro-3-phenyl-propyl] ethanoate Openeye Name: [(2R)-2-benzyl-3-hydroxy-2-nitro-propyl] acetate CAS Name: acetic acid [(2R)-2-(hydroxymethyl)-2-nitro-3-phenylpropyl] ester IUPAC Name: [(2R)-2-benzyl-3-hydroxy-2-nitropropyl] acetate Traditional Name: acetic acid [(2R)-2-benzyl-3-hydroxy-2-nitro-propyl] ester Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CC1=CC=CC=C1)(CO)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC[C@@](CC1=CC=CC=C1)(CO)[N+](=O)[O-]

InChI

InChI=1S/C12H15NO5/c1-10(15)18-9-12(8-14,13(16)17)7-11-5-3-2-4-6-11/h2-6,14H,7-9H2,1H3/t12-/m1/s1