5-nitro-2,4-dipropoxy-benzoic acid

Systemtic Name: 5-nitro-2,4-dipropoxy-benzoic acid Openeye Name: 5-nitro-2,4-dipropoxy-benzoic acid CAS Name: 5-nitro-2,4-dipropoxybenzoic acid IUPAC Name: 5-nitro-2,4-dipropoxybenzoic acid Traditional Name: 5-nitro-2,4-dipropoxy-benzoic acid Formula: C13H17NO6 MolecularWeight: 283.27718

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])OCCC

Isomeric SMILES

CCCOC1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])OCCC

InChI

InChI=1S/C13H17NO6/c1-3-5-19-11-8-12(20-6-4-2)10(14(17)18)7-9(11)13(15)16/h7-8H,3-6H2,1-2H3,(H,15,16)