(E)-3-[4-bromanyl-2-(4-methylphenoxy)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-bromanyl-2-(4-methylphenoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-bromo-2-(4-methylphenoxy)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-bromo-2-(4-methylphenoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-bromo-2-(4-methylphenoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-bromo-2-(4-methylphenoxy)phenyl]acrylic acid Formula: C16H13BrO3 MolecularWeight: 333.17662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrO3/c1-11-2-7-14(8-3-11)20-15-10-13(17)6-4-12(15)5-9-16(18)19/h2-10H,1H3,(H,18,19)/b9-5+