(E)-3-[2-(2,3,6-trimethylphenoxy)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-(2,3,6-trimethylphenoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-(2,3,6-trimethylphenoxy)phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-(2,3,6-trimethylphenoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(2,3,6-trimethylphenoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-(2,3,6-trimethylphenoxy)phenyl]acrylic acid Formula: C18H18O3 MolecularWeight: 282.33372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OC2=CC=CC=C2C=CC(=O)O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC2=CC=CC=C2/C=C/C(=O)O)C

InChI

InChI=1S/C18H18O3/c1-12-8-9-13(2)18(14(12)3)21-16-7-5-4-6-15(16)10-11-17(19)20/h4-11H,1-3H3,(H,19,20)/b11-10+