2,4-bis(3-oxidanylpropyl)benzene-1,3-dicarboxylate

Systemtic Name: 2,4-bis(3-oxidanylpropyl)benzene-1,3-dicarboxylate Openeye Name: 2,4-bis(3-hydroxypropyl)benzene-1,3-dicarboxylate CAS Name: 2,4-bis(3-hydroxypropyl)benzene-1,3-dicarboxylate IUPAC Name: 2,4-bis(3-hydroxypropyl)benzene-1,3-dicarboxylate Traditional Name: 2,4-bis(3-hydroxypropyl)isophthalate Formula: C14H16O6-2 MolecularWeight: 280.27324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1CCCO)C(=O)[O-])CCCO)C(=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1CCCO)C(=O)[O-])CCCO)C(=O)[O-]

InChI

InChI=1S/C14H18O6/c15-7-1-3-9-5-6-11(13(17)18)10(4-2-8-16)12(9)14(19)20/h5-6,15-16H,1-4,7-8H2,(H,17,18)(H,19,20)/p-2