4-butoxy-3-methoxy-5-nitro-benzoic acid

Systemtic Name: 4-butoxy-3-methoxy-5-nitro-benzoic acid Openeye Name: 4-butoxy-3-methoxy-5-nitro-benzoic acid CAS Name: 4-butoxy-3-methoxy-5-nitrobenzoic acid IUPAC Name: 4-butoxy-3-methoxy-5-nitrobenzoic acid Traditional Name: 4-butoxy-3-methoxy-5-nitro-benzoic acid Formula: C12H15NO6 MolecularWeight: 269.2506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1OC)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=C(C=C(C=C1OC)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H15NO6/c1-3-4-5-19-11-9(13(16)17)6-8(12(14)15)7-10(11)18-2/h6-7H,3-5H2,1-2H3,(H,14,15)