(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-[(5-methyl-1,2-oxazol-3-yl)oxy]ethanoate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-[(5-methyl-1,2-oxazol-3-yl)oxy]ethanoate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(5-methylisoxazol-3-yl)oxyacetate CAS Name: 2-[(5-methyl-3-isoxazolyl)oxy]acetic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate Traditional Name: 2-(5-methylisoxazol-3-yl)oxyacetic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C15H14N2O8 MolecularWeight: 350.28026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)OCC(=O)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

Isomeric SMILES

CC1=CC(=NO1)OCC(=O)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

InChI

InChI=1S/C15H14N2O8/c1-9-2-13(16-25-9)22-7-14(18)23-6-11-4-12(17(19)20)3-10-5-21-8-24-15(10)11/h2-4H,5-8H2,1H3