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

Systemtic Name: (E)-3-[4-(2-pyridin-4-ylethyl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[2-(4-pyridyl)ethyl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(2-pyridin-4-ylethyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(2-pyridin-4-ylethyl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[2-(4-pyridyl)ethyl]phenyl]acrylic acid Formula: C16H15NO2 MolecularWeight: 253.2958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC2=CC=NC=C2)C=CC(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCC2=CC=NC=C2)/C=C/C(=O)O

InChI

InChI=1S/C16H15NO2/c18-16(19)8-7-14-3-1-13(2-4-14)5-6-15-9-11-17-12-10-15/h1-4,7-12H,5-6H2,(H,18,19)/b8-7+