3-[2-[5-chloranyl-2-(pyridin-4-ylmethoxy)phenyl]phenyl]benzoic acid

Systemtic Name: 3-[2-[5-chloranyl-2-(pyridin-4-ylmethoxy)phenyl]phenyl]benzoic acid Openeye Name: 3-[2-[5-chloro-2-(4-pyridylmethoxy)phenyl]phenyl]benzoic acid CAS Name: 3-[2-[5-chloro-2-(pyridin-4-ylmethoxy)phenyl]phenyl]benzoic acid IUPAC Name: 3-[2-[5-chloro-2-(pyridin-4-ylmethoxy)phenyl]phenyl]benzoic acid Traditional Name: 3-[2-[5-chloro-2-(4-pyridylmethoxy)phenyl]phenyl]benzoic acid Formula: C25H18ClNO3 MolecularWeight: 415.86832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC(=CC=C2)C(=O)O)C3=C(C=CC(=C3)Cl)OCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC(=CC=C2)C(=O)O)C3=C(C=CC(=C3)Cl)OCC4=CC=NC=C4

InChI

InChI=1S/C25H18ClNO3/c26-20-8-9-24(30-16-17-10-12-27-13-11-17)23(15-20)22-7-2-1-6-21(22)18-4-3-5-19(14-18)25(28)29/h1-15H,16H2,(H,28,29)