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

Systemtic Name: (E)-3-[4-bromanyl-2-(3-ethylphenoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-bromo-2-(3-ethylphenoxy)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-bromo-2-(3-ethylphenoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-bromo-2-(3-ethylphenoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-bromo-2-(3-ethylphenoxy)phenyl]acrylic acid Formula: C17H15BrO3 MolecularWeight: 347.2032

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OC2=C(C=CC(=C2)Br)C=CC(=O)O

Isomeric SMILES

CCC1=CC(=CC=C1)OC2=C(C=CC(=C2)Br)/C=C/C(=O)O

InChI

InChI=1S/C17H15BrO3/c1-2-12-4-3-5-15(10-12)21-16-11-14(18)8-6-13(16)7-9-17(19)20/h3-11H,2H2,1H3,(H,19,20)/b9-7+