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2,3,5,6-tetrahexoxybenzoic acid

2,3,5,6-tetrahexoxybenzoic acid

Systemtic Name:2,3,5,6-tetrahexoxybenzoic acid
Openeye Name:2,3,5,6-tetrahexoxybenzoic acid
CAS Name:2,3,5,6-tetrahexoxybenzoic acid
IUPAC Name:2,3,5,6-tetrahexoxybenzoic acid
Traditional Name:2,3,5,6-tetrahexoxybenzoic acid
Formula: C31H54O6
MolecularWeight: 522.75686
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=C(C(=C1OCCCCCC)C(=O)O)OCCCCCC)OCCCCCC


Isomeric SMILES

CCCCCCOC1=CC(=C(C(=C1OCCCCCC)C(=O)O)OCCCCCC)OCCCCCC


InChI

InChI=1S/C31H54O6/c1-5-9-13-17-21-34-26-25-27(35-22-18-14-10-6-2)30(37-24-20-16-12-8-4)28(31(32)33)29(26)36-23-19-15-11-7-3/h25H,5-24H2,1-4H3,(H,32,33)


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