3-(1-pyridin-2-yl-2,2-dipyridin-3-yl-ethyl)benzoic acid

Systemtic Name: 3-(1-pyridin-2-yl-2,2-dipyridin-3-yl-ethyl)benzoic acid Openeye Name: 3-[1-(2-pyridyl)-2,2-bis(3-pyridyl)ethyl]benzoic acid CAS Name: 3-[1-(2-pyridinyl)-2,2-bis(3-pyridinyl)ethyl]benzoic acid IUPAC Name: 3-(1-pyridin-2-yl-2,2-dipyridin-3-ylethyl)benzoic acid Traditional Name: 3-[1-(2-pyridyl)-2,2-bis(3-pyridyl)ethyl]benzoic acid Formula: C24H19N3O2 MolecularWeight: 381.42656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(C2=CC=CC(=C2)C(=O)O)C(C3=CN=CC=C3)C4=CN=CC=C4

Isomeric SMILES

C1=CC=NC(=C1)C(C2=CC=CC(=C2)C(=O)O)C(C3=CN=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C24H19N3O2/c28-24(29)18-7-3-6-17(14-18)23(21-10-1-2-13-27-21)22(19-8-4-11-25-15-19)20-9-5-12-26-16-20/h1-16,22-23H,(H,28,29)