O1-(2-hydroxyethyl) O5-[4-[(E)-3-phenylprop-2-enoyl]phenyl] 2,2,4-trimethylpentanedioate

Systemtic Name: O1-(2-hydroxyethyl) O5-[4-[(E)-3-phenylprop-2-enoyl]phenyl] 2,2,4-trimethylpentanedioate Openeye Name: O1-(2-hydroxyethyl) O5-[4-[(E)-3-phenylprop-2-enoyl]phenyl] 2,2,4-trimethylpentanedioate CAS Name: 2,2,4-trimethylpentanedioic acid O1-(2-hydroxyethyl) ester O5-[4-[(E)-1-oxo-3-phenylprop-2-enyl]phenyl] ester IUPAC Name: 1-O-(2-hydroxyethyl) 5-O-[4-[(E)-3-phenylprop-2-enoyl]phenyl] 2,2,4-trimethylpentanedioate Traditional Name: 2,2,4-trimethylglutaric acid O1-(2-hydroxyethyl) ester O5-[4-[(E)-3-phenylacryloyl]phenyl] ester Formula: C25H28O6 MolecularWeight: 424.48622

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)(C)C(=O)OCCO)C(=O)OC1=CC=C(C=C1)C(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC(CC(C)(C)C(=O)OCCO)C(=O)OC1=CC=C(C=C1)C(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C25H28O6/c1-18(17-25(2,3)24(29)30-16-15-26)23(28)31-21-12-10-20(11-13-21)22(27)14-9-19-7-5-4-6-8-19/h4-14,18,26H,15-17H2,1-3H3/b14-9+