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3-[6-(2,3-dicarboxyphenoxy)hexa-2,4-diynoxy]phthalic acid

3-[6-(2,3-dicarboxyphenoxy)hexa-2,4-diynoxy]phthalic acid

Systemtic Name:3-[6-(2,3-dicarboxyphenoxy)hexa-2,4-diynoxy]phthalic acid
Openeye Name:3-[6-(2,3-dicarboxyphenoxy)hexa-2,4-diynoxy]phthalic acid
CAS Name:3-[6-(2,3-dicarboxyphenoxy)hexa-2,4-diynoxy]phthalic acid
IUPAC Name:3-[6-(2,3-dicarboxyphenoxy)hexa-2,4-diynoxy]phthalic acid
Traditional Name:3-[6-(2,3-dicarboxyphenoxy)hexa-2,4-diynoxy]phthalic acid
Formula: C22H14O10
MolecularWeight: 438.34056
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)OCC#CC#CCOC2=CC=CC(=C2C(=O)O)C(=O)O)C(=O)O)C(=O)O


Isomeric SMILES

C1=CC(=C(C(=C1)OCC#CC#CCOC2=CC=CC(=C2C(=O)O)C(=O)O)C(=O)O)C(=O)O


InChI

InChI=1S/C22H14O10/c23-19(24)13-7-5-9-15(17(13)21(27)28)31-11-3-1-2-4-12-32-16-10-6-8-14(20(25)26)18(16)22(29)30/h5-10H,11-12H2,(H,23,24)(H,25,26)(H,27,28)(H,29,30)


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