[(1R)-1-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)propyl] ethanoate

Systemtic Name: [(1R)-1-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)propyl] ethanoate Openeye Name: [(1R)-1-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)propyl] acetate CAS Name: acetic acid [(1R)-1-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)propyl] ester IUPAC Name: [(1R)-1-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)propyl] acetate Traditional Name: acetic acid [(1R)-1-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)propyl] ester Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1[N+](=O)[O-])OCCO2)OC(=O)C

Isomeric SMILES

CC[C@H](C1=CC2=C(C=C1[N+](=O)[O-])OCCO2)OC(=O)C

InChI

InChI=1S/C13H15NO6/c1-3-11(20-8(2)15)9-6-12-13(19-5-4-18-12)7-10(9)14(16)17/h6-7,11H,3-5H2,1-2H3/t11-/m1/s1