[(5R,6R)-6-oxidanyl-5-[(E)-3-phenylprop-2-enoyl]oxy-cyclohexa-1,3-dien-1-yl]methyl benzoate

Systemtic Name: [(5R,6R)-6-oxidanyl-5-[(E)-3-phenylprop-2-enoyl]oxy-cyclohexa-1,3-dien-1-yl]methyl benzoate Openeye Name: [(5R,6R)-6-hydroxy-5-[(E)-3-phenylprop-2-enoyl]oxy-cyclohexa-1,3-dien-1-yl]methyl benzoate CAS Name: benzoic acid [(5R,6R)-6-hydroxy-5-[(E)-1-oxo-3-phenylprop-2-enoxy]-1-cyclohexa-1,3-dienyl]methyl ester IUPAC Name: [(5R,6R)-6-hydroxy-5-[(E)-3-phenylprop-2-enoyl]oxycyclohexa-1,3-dien-1-yl]methyl benzoate Traditional Name: benzoic acid [(5R,6R)-6-hydroxy-5-[(E)-3-phenylacryloyl]oxy-cyclohexa-1,3-dien-1-yl]methyl ester Formula: C23H20O5 MolecularWeight: 376.4019

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)OC2C=CC=C(C2O)COC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)O[C@@H]2C=CC=C([C@H]2O)COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H20O5/c24-21(15-14-17-8-3-1-4-9-17)28-20-13-7-12-19(22(20)25)16-27-23(26)18-10-5-2-6-11-18/h1-15,20,22,25H,16H2/b15-14+/t20-,22-/m1/s1