2-[(3Z)-2-ethyl-6-fluoranyl-3-[(4-phenylmethoxyphenyl)methylidene]inden-1-yl]ethanoic acid

Systemtic Name: 2-[(3Z)-2-ethyl-6-fluoranyl-3-[(4-phenylmethoxyphenyl)methylidene]inden-1-yl]ethanoic acid Openeye Name: 2-[(3Z)-3-[(4-benzyloxyphenyl)methylene]-2-ethyl-6-fluoro-inden-1-yl]acetic acid CAS Name: 2-[(3Z)-2-ethyl-6-fluoro-3-[(4-phenylmethoxyphenyl)methylidene]-1-indenyl]acetic acid IUPAC Name: 2-[(3Z)-2-ethyl-6-fluoro-3-[(4-phenylmethoxyphenyl)methylidene]inden-1-yl]acetic acid Traditional Name: 2-[(3Z)-3-(4-benzoxybenzylidene)-2-ethyl-6-fluoro-inden-1-yl]acetic acid Formula: C27H23FO3 MolecularWeight: 414.468123

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C1=CC3=CC=C(C=C3)OCC4=CC=CC=C4)C=CC(=C2)F)CC(=O)O

Isomeric SMILES

CCC\1=C(C2=C(/C1=C\C3=CC=C(C=C3)OCC4=CC=CC=C4)C=CC(=C2)F)CC(=O)O

InChI

InChI=1S/C27H23FO3/c1-2-22-24(23-13-10-20(28)15-25(23)26(22)16-27(29)30)14-18-8-11-21(12-9-18)31-17-19-6-4-3-5-7-19/h3-15H,2,16-17H2,1H3,(H,29,30)/b24-14-