(E)-3-[2-chloranyl-6-(2-ethylhexoxy)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-chloranyl-6-(2-ethylhexoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-chloro-6-(2-ethylhexoxy)phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-chloro-6-(2-ethylhexoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-chloro-6-(2-ethylhexoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-chloro-6-(2-ethylhexoxy)phenyl]acrylic acid Formula: C17H23ClO3 MolecularWeight: 310.81572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23ClO3/c1-3-5-7-13(4-2)12-21-16-9-6-8-15(18)14(16)10-11-17(19)20/h6,8-11,13H,3-5,7,12H2,1-2H3,(H,19,20)/b11-10+