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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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