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

Systemtic Name: (E)-2-bromanyl-3-[4-(pyridin-3-ylmethyl)phenyl]prop-2-enoic acid Openeye Name: (E)-2-bromo-3-[4-(3-pyridylmethyl)phenyl]prop-2-enoic acid CAS Name: (E)-2-bromo-3-[4-(3-pyridinylmethyl)phenyl]-2-propenoic acid IUPAC Name: (E)-2-bromo-3-[4-(pyridin-3-ylmethyl)phenyl]prop-2-enoic acid Traditional Name: (E)-2-bromo-3-[4-(3-pyridylmethyl)phenyl]acrylic acid Formula: C15H12BrNO2 MolecularWeight: 318.16528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC2=CC=C(C=C2)C=C(C(=O)O)Br

Isomeric SMILES

C1=CC(=CN=C1)CC2=CC=C(C=C2)/C=C(\C(=O)O)/Br

InChI

InChI=1S/C15H12BrNO2/c16-14(15(18)19)9-12-5-3-11(4-6-12)8-13-2-1-7-17-10-13/h1-7,9-10H,8H2,(H,18,19)/b14-9+