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

Systemtic Name: [4-(2,4-dinitrophenoxy)-1-oxidanyl-butan-2-yl] ethanoate Openeye Name: [3-(2,4-dinitrophenoxy)-1-(hydroxymethyl)propyl] acetate CAS Name: acetic acid [4-(2,4-dinitrophenoxy)-1-hydroxybutan-2-yl] ester IUPAC Name: [4-(2,4-dinitrophenoxy)-1-hydroxybutan-2-yl] acetate Traditional Name: acetic acid [3-(2,4-dinitrophenoxy)-1-methylol-propyl] ester Formula: C12H14N2O8 MolecularWeight: 314.24816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O8/c1-8(16)22-10(7-15)4-5-21-12-3-2-9(13(17)18)6-11(12)14(19)20/h2-3,6,10,15H,4-5,7H2,1H3