[1-[2-(hydroxymethyl)phenyl]-2-nitro-propyl] ethanoate

Systemtic Name: [1-[2-(hydroxymethyl)phenyl]-2-nitro-propyl] ethanoate Openeye Name: [1-[2-(hydroxymethyl)phenyl]-2-nitro-propyl] acetate CAS Name: acetic acid [1-[2-(hydroxymethyl)phenyl]-2-nitropropyl] ester IUPAC Name: [1-[2-(hydroxymethyl)phenyl]-2-nitropropyl] acetate Traditional Name: acetic acid [1-(2-methylolphenyl)-2-nitro-propyl] ester Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1CO)OC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(C(C1=CC=CC=C1CO)OC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C12H15NO5/c1-8(13(16)17)12(18-9(2)15)11-6-4-3-5-10(11)7-14/h3-6,8,12,14H,7H2,1-2H3