2-[4-[(E)-3-(4-hexoxyphenyl)-3-oxidanylidene-prop-1-enyl]-2,6-dimethyl-phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[(E)-3-(4-hexoxyphenyl)-3-oxidanylidene-prop-1-enyl]-2,6-dimethyl-phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[(E)-3-(4-hexoxyphenyl)-3-oxo-prop-1-enyl]-2,6-dimethyl-phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[(E)-3-(4-hexoxyphenyl)-3-oxoprop-1-enyl]-2,6-dimethylphenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[(E)-3-(4-hexoxyphenyl)-3-oxoprop-1-enyl]-2,6-dimethylphenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[(E)-3-(4-hexoxyphenyl)-3-keto-prop-1-enyl]-2,6-dimethyl-phenoxy]-2-methyl-propionic acid Formula: C27H34O5 MolecularWeight: 438.55586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)C=CC2=CC(=C(C(=C2)C)OC(C)(C)C(=O)O)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)/C=C/C2=CC(=C(C(=C2)C)OC(C)(C)C(=O)O)C

InChI

InChI=1S/C27H34O5/c1-6-7-8-9-16-31-23-13-11-22(12-14-23)24(28)15-10-21-17-19(2)25(20(3)18-21)32-27(4,5)26(29)30/h10-15,17-18H,6-9,16H2,1-5H3,(H,29,30)/b15-10+