[4-(4-nitrophenoxy)-1-oxidanyl-butan-2-yl] ethanoate

Systemtic Name: [4-(4-nitrophenoxy)-1-oxidanyl-butan-2-yl] ethanoate Openeye Name: [1-(hydroxymethyl)-3-(4-nitrophenoxy)propyl] acetate CAS Name: acetic acid [1-hydroxy-4-(4-nitrophenoxy)butan-2-yl] ester IUPAC Name: [1-hydroxy-4-(4-nitrophenoxy)butan-2-yl] acetate Traditional Name: acetic acid [1-methylol-3-(4-nitrophenoxy)propyl] ester Formula: C12H15NO6 MolecularWeight: 269.2506

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCOC1=CC=C(C=C1)[N+](=O)[O-])CO

Isomeric SMILES

CC(=O)OC(CCOC1=CC=C(C=C1)[N+](=O)[O-])CO

InChI

InChI=1S/C12H15NO6/c1-9(15)19-12(8-14)6-7-18-11-4-2-10(3-5-11)13(16)17/h2-5,12,14H,6-8H2,1H3