3-[3-(pyridin-4-ylmethoxy)phenyl]furan-2-carboxylic acid

Systemtic Name: 3-[3-(pyridin-4-ylmethoxy)phenyl]furan-2-carboxylic acid Openeye Name: 3-[3-(4-pyridylmethoxy)phenyl]furan-2-carboxylic acid CAS Name: 3-[3-(pyridin-4-ylmethoxy)phenyl]-2-furancarboxylic acid IUPAC Name: 3-[3-(pyridin-4-ylmethoxy)phenyl]furan-2-carboxylic acid Traditional Name: 3-[3-(4-pyridylmethoxy)phenyl]-2-furoic acid Formula: C17H13NO4 MolecularWeight: 295.28942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC2=CC=NC=C2)C3=C(OC=C3)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)OCC2=CC=NC=C2)C3=C(OC=C3)C(=O)O

InChI

InChI=1S/C17H13NO4/c19-17(20)16-15(6-9-21-16)13-2-1-3-14(10-13)22-11-12-4-7-18-8-5-12/h1-10H,11H2,(H,19,20)