(E)-3-[5-bromanyl-2-(pyridin-3-ylmethoxy)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[5-bromanyl-2-(pyridin-3-ylmethoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[5-bromo-2-(3-pyridylmethoxy)phenyl]prop-2-enoic acid CAS Name: (E)-3-[5-bromo-2-(3-pyridinylmethoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[5-bromo-2-(pyridin-3-ylmethoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[5-bromo-2-(3-pyridylmethoxy)phenyl]acrylic acid Formula: C15H12BrNO3 MolecularWeight: 334.16468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)COC2=C(C=C(C=C2)Br)C=CC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)COC2=C(C=C(C=C2)Br)/C=C/C(=O)O

InChI

InChI=1S/C15H12BrNO3/c16-13-4-5-14(12(8-13)3-6-15(18)19)20-10-11-2-1-7-17-9-11/h1-9H,10H2,(H,18,19)/b6-3+