2-(3-methylbutoxy)-5-nitro-benzoate

Systemtic Name: 2-(3-methylbutoxy)-5-nitro-benzoate Openeye Name: 2-isopentyloxy-5-nitro-benzoate CAS Name: 2-(3-methylbutoxy)-5-nitrobenzoate IUPAC Name: 2-(3-methylbutoxy)-5-nitrobenzoate Traditional Name: 2-isoamoxy-5-nitro-benzoate Formula: C12H14NO5- MolecularWeight: 252.24326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C12H15NO5/c1-8(2)5-6-18-11-4-3-9(13(16)17)7-10(11)12(14)15/h3-4,7-8H,5-6H2,1-2H3,(H,14,15)/p-1