bis(1-hydroxyethyl) 5-cyanobenzene-1,3-dicarboxylate

Systemtic Name: bis(1-hydroxyethyl) 5-cyanobenzene-1,3-dicarboxylate Openeye Name: bis(1-hydroxyethyl) 5-cyanobenzene-1,3-dicarboxylate CAS Name: 5-cyanobenzene-1,3-dicarboxylic acid bis(1-hydroxyethyl) ester IUPAC Name: bis(1-hydroxyethyl) 5-cyanobenzene-1,3-dicarboxylate Traditional Name: 5-cyanobenzene-1,3-dicarboxylic acid bis(1-hydroxyethyl) ester Formula: C13H13NO6 MolecularWeight: 279.24542

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Descriptors Computed from Structure

Canonical SMILES:

CC(O)OC(=O)C1=CC(=CC(=C1)C#N)C(=O)OC(C)O

Isomeric SMILES

CC(O)OC(=O)C1=CC(=CC(=C1)C#N)C(=O)OC(C)O

InChI

InChI=1S/C13H13NO6/c1-7(15)19-12(17)10-3-9(6-14)4-11(5-10)13(18)20-8(2)16/h3-5,7-8,15-16H,1-2H3