(E)-3-[4-(2-ethylhexoxy)-3-fluoranyl-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(2-ethylhexoxy)-3-fluoranyl-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(2-ethylhexoxy)-3-fluoro-phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(2-ethylhexoxy)-3-fluorophenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(2-ethylhexoxy)-3-fluorophenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(2-ethylhexoxy)-3-fluoro-phenyl]acrylic acid Formula: C17H23FO3 MolecularWeight: 294.361123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC1=C(C=C(C=C1)C=CC(=O)O)F

Isomeric SMILES

CCCCC(CC)COC1=C(C=C(C=C1)/C=C/C(=O)O)F

InChI

InChI=1S/C17H23FO3/c1-3-5-6-13(4-2)12-21-16-9-7-14(11-15(16)18)8-10-17(19)20/h7-11,13H,3-6,12H2,1-2H3,(H,19,20)/b10-8+