2-(3,5-dimethyl-4-nitro-phenoxy)ethanoate

Systemtic Name: 2-(3,5-dimethyl-4-nitro-phenoxy)ethanoate Openeye Name: 2-(3,5-dimethyl-4-nitro-phenoxy)acetate CAS Name: 2-(3,5-dimethyl-4-nitrophenoxy)acetate IUPAC Name: 2-(3,5-dimethyl-4-nitrophenoxy)acetate Traditional Name: 2-(3,5-dimethyl-4-nitro-phenoxy)acetate Formula: C10H10NO5- MolecularWeight: 224.1901

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1[N+](=O)[O-])C)OCC(=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1[N+](=O)[O-])C)OCC(=O)[O-]

InChI

InChI=1S/C10H11NO5/c1-6-3-8(16-5-9(12)13)4-7(2)10(6)11(14)15/h3-4H,5H2,1-2H3,(H,12,13)/p-1