ethane; 3,4,5-tris(oxidanyl)benzoate

Systemtic Name: ethane; 3,4,5-tris(oxidanyl)benzoate Openeye Name: ethane; 3,4,5-trihydroxybenzoate CAS Name: ethane; 3,4,5-trihydroxybenzoate IUPAC Name: ethane; 3,4,5-trihydroxybenzoate Traditional Name: ethane; 3,4,5-trihydroxybenzoate Formula: C16H16O10-2 MolecularWeight: 368.29224

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Descriptors Computed from Structure

Canonical SMILES:

CC.C1=C(C=C(C(=C1O)O)O)C(=O)[O-].C1=C(C=C(C(=C1O)O)O)C(=O)[O-]

Isomeric SMILES

CC.C1=C(C=C(C(=C1O)O)O)C(=O)[O-].C1=C(C=C(C(=C1O)O)O)C(=O)[O-]

InChI

InChI=1S/2C7H6O5.C2H6/c2*8-4-1-3(7(11)12)2-5(9)6(4)10;1-2/h2*1-2,8-10H,(H,11,12);1-2H3/p-2