4-[(E)-3-[3-(2-hydroxyethyl)-4-oxidanyl-phenyl]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: 4-[(E)-3-[3-(2-hydroxyethyl)-4-oxidanyl-phenyl]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: 4-[(E)-3-[4-hydroxy-3-(2-hydroxyethyl)phenyl]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[4-hydroxy-3-(2-hydroxyethyl)phenyl]-3-oxoprop-1-enyl]benzoate IUPAC Name: 4-[(E)-3-[4-hydroxy-3-(2-hydroxyethyl)phenyl]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-[4-hydroxy-3-(2-hydroxyethyl)phenyl]-3-keto-prop-1-enyl]benzoate Formula: C18H15O5- MolecularWeight: 311.3087

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)C2=CC(=C(C=C2)O)CCO)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H16O5/c19-10-9-15-11-14(6-8-17(15)21)16(20)7-3-12-1-4-13(5-2-12)18(22)23/h1-8,11,19,21H,9-10H2,(H,22,23)/p-1/b7-3+