(4-hydroxyphenyl) (E)-3-[3,5-bis(2-methylpentan-2-yl)phenyl]prop-2-enoate

Systemtic Name: (4-hydroxyphenyl) (E)-3-[3,5-bis(2-methylpentan-2-yl)phenyl]prop-2-enoate Openeye Name: (4-hydroxyphenyl) (E)-3-[3,5-bis(1,1-dimethylbutyl)phenyl]prop-2-enoate CAS Name: (E)-3-[3,5-bis(2-methylpentan-2-yl)phenyl]-2-propenoic acid (4-hydroxyphenyl) ester IUPAC Name: (4-hydroxyphenyl) (E)-3-[3,5-bis(2-methylpentan-2-yl)phenyl]prop-2-enoate Traditional Name: (E)-3-[3,5-bis(1,1-dimethylbutyl)phenyl]acrylic acid (4-hydroxyphenyl) ester Formula: C27H36O3 MolecularWeight: 408.57294

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)C1=CC(=CC(=C1)C=CC(=O)OC2=CC=C(C=C2)O)C(C)(C)CCC

Isomeric SMILES

CCCC(C)(C)C1=CC(=CC(=C1)/C=C/C(=O)OC2=CC=C(C=C2)O)C(C)(C)CCC

InChI

InChI=1S/C27H36O3/c1-7-15-26(3,4)21-17-20(18-22(19-21)27(5,6)16-8-2)9-14-25(29)30-24-12-10-23(28)11-13-24/h9-14,17-19,28H,7-8,15-16H2,1-6H3/b14-9+