2-pyridin-4-yl-3-[3-[6-(pyridin-4-ylmethyl)quinolin-8-yl]phenyl]propanoic acid

Systemtic Name: 2-pyridin-4-yl-3-[3-[6-(pyridin-4-ylmethyl)quinolin-8-yl]phenyl]propanoic acid Openeye Name: 2-(4-pyridyl)-3-[3-[6-(4-pyridylmethyl)-8-quinolyl]phenyl]propanoic acid CAS Name: 2-pyridin-4-yl-3-[3-[6-(pyridin-4-ylmethyl)-8-quinolinyl]phenyl]propanoic acid IUPAC Name: 2-pyridin-4-yl-3-[3-[6-(pyridin-4-ylmethyl)quinolin-8-yl]phenyl]propanoic acid Traditional Name: 2-(4-pyridyl)-3-[3-[6-(4-pyridylmethyl)-8-quinolyl]phenyl]propionic acid Formula: C29H23N3O2 MolecularWeight: 445.51182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CC(C2=CC=NC=C2)C(=O)O)C3=C4C(=CC(=C3)CC5=CC=NC=C5)C=CC=N4

Isomeric SMILES

C1=CC(=CC(=C1)CC(C2=CC=NC=C2)C(=O)O)C3=C4C(=CC(=C3)CC5=CC=NC=C5)C=CC=N4

InChI

InChI=1S/C29H23N3O2/c33-29(34)27(23-8-13-31-14-9-23)18-21-3-1-4-24(16-21)26-19-22(15-20-6-11-30-12-7-20)17-25-5-2-10-32-28(25)26/h1-14,16-17,19,27H,15,18H2,(H,33,34)