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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=C(C=CC(=C2)Br)C=CC(=O)O

Isomeric SMILES

CC1=CC=CC=C1OC2=C(C=CC(=C2)Br)/C=C/C(=O)O

InChI

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