3-carboxy-4-(2-hydroxyethyl)-2-[4-(2-hydroxyethyl)phenyl]benzoate

Systemtic Name: 3-carboxy-4-(2-hydroxyethyl)-2-[4-(2-hydroxyethyl)phenyl]benzoate Openeye Name: 3-carboxy-4-(2-hydroxyethyl)-2-[4-(2-hydroxyethyl)phenyl]benzoate CAS Name: 3-carboxy-4-(2-hydroxyethyl)-2-[4-(2-hydroxyethyl)phenyl]benzoate IUPAC Name: 3-carboxy-4-(2-hydroxyethyl)-2-[4-(2-hydroxyethyl)phenyl]benzoate Traditional Name: 3-carboxy-4-(2-hydroxyethyl)-2-[4-(2-hydroxyethyl)phenyl]benzoate Formula: C18H17O6- MolecularWeight: 329.32398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCO)C2=C(C=CC(=C2C(=O)O)CCO)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CCO)C2=C(C=CC(=C2C(=O)O)CCO)C(=O)[O-]

InChI

InChI=1S/C18H18O6/c19-9-7-11-1-3-12(4-2-11)15-14(17(21)22)6-5-13(8-10-20)16(15)18(23)24/h1-6,19-20H,7-10H2,(H,21,22)(H,23,24)/p-1