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3-nitro-4-[oxidanyl(3-oxidanylpropoxy)boranyl]benzoic acid

3-nitro-4-[oxidanyl(3-oxidanylpropoxy)boranyl]benzoic acid

Systemtic Name:3-nitro-4-[oxidanyl(3-oxidanylpropoxy)boranyl]benzoic acid
Openeye Name:4-[hydroxy(3-hydroxypropoxy)boranyl]-3-nitro-benzoic acid
CAS Name:4-[hydroxy(3-hydroxypropoxy)boranyl]-3-nitrobenzoic acid
IUPAC Name:4-[hydroxy(3-hydroxypropoxy)boranyl]-3-nitrobenzoic acid
Traditional Name:4-[hydroxy(3-hydroxypropoxy)boranyl]-3-nitro-benzoic acid
Formula: C10H12BNO7
MolecularWeight: 269.01578
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Descriptors Computed from Structure

Canonical SMILES:

B(C1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-])(O)OCCCO


Isomeric SMILES

B(C1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-])(O)OCCCO


InChI

InChI=1S/C10H12BNO7/c13-4-1-5-19-11(16)8-3-2-7(10(14)15)6-9(8)12(17)18/h2-3,6,13,16H,1,4-5H2,(H,14,15)


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