(6-nitro-1,3-benzodioxol-5-yl) ethanoate

Systemtic Name: (6-nitro-1,3-benzodioxol-5-yl) ethanoate Openeye Name: (6-nitro-1,3-benzodioxol-5-yl) acetate CAS Name: acetic acid (6-nitro-1,3-benzodioxol-5-yl) ester IUPAC Name: (6-nitro-1,3-benzodioxol-5-yl) acetate Traditional Name: acetic acid (6-nitro-1,3-benzodioxol-5-yl) ester Formula: C9H7NO6 MolecularWeight: 225.15498

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC2=C(C=C1[N+](=O)[O-])OCO2

Isomeric SMILES

CC(=O)OC1=CC2=C(C=C1[N+](=O)[O-])OCO2

InChI

InChI=1S/C9H7NO6/c1-5(11)16-7-3-9-8(14-4-15-9)2-6(7)10(12)13/h2-3H,4H2,1H3