methyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitro-butanoate

Systemtic Name: methyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitro-butanoate Openeye Name: methyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitro-butanoate CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobutanoic acid methyl ester IUPAC Name: methyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitrobutanoate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-nitro-butyric acid methyl ester Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C[N+](=O)[O-])C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

COC(=O)CC(C[N+](=O)[O-])C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C13H15NO6/c1-18-13(15)7-10(8-14(16)17)9-2-3-11-12(6-9)20-5-4-19-11/h2-3,6,10H,4-5,7-8H2,1H3