5-(3-methylbutoxy)-2-nitro-benzoic acid

Systemtic Name: 5-(3-methylbutoxy)-2-nitro-benzoic acid Openeye Name: 5-isopentyloxy-2-nitro-benzoic acid CAS Name: 5-(3-methylbutoxy)-2-nitrobenzoic acid IUPAC Name: 5-(3-methylbutoxy)-2-nitrobenzoic acid Traditional Name: 5-isoamoxy-2-nitro-benzoic acid Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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