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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC(=CC=C1)CC2=CC=NC=C2)C(=O)O

Isomeric SMILES

C/C(=C\C1=CC(=CC=C1)CC2=CC=NC=C2)/C(=O)O

InChI

InChI=1S/C16H15NO2/c1-12(16(18)19)9-14-3-2-4-15(11-14)10-13-5-7-17-8-6-13/h2-9,11H,10H2,1H3,(H,18,19)/b12-9+