5-(2-methylpropoxy)-2-nitro-benzoate

Systemtic Name: 5-(2-methylpropoxy)-2-nitro-benzoate Openeye Name: 5-isobutoxy-2-nitro-benzoate CAS Name: 5-(2-methylpropoxy)-2-nitrobenzoate IUPAC Name: 5-(2-methylpropoxy)-2-nitrobenzoate Traditional Name: 5-isobutoxy-2-nitro-benzoate Formula: C11H12NO5- MolecularWeight: 238.21668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(C)COC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C11H13NO5/c1-7(2)6-17-8-3-4-10(12(15)16)9(5-8)11(13)14/h3-5,7H,6H2,1-2H3,(H,13,14)/p-1