2-[3-cyano-5-(2-methoxyethoxy)-4-(4-methoxyphenyl)phenyl]-5-oxidanyl-pyridine-4-carboxylic acid

Systemtic Name: 2-[3-cyano-5-(2-methoxyethoxy)-4-(4-methoxyphenyl)phenyl]-5-oxidanyl-pyridine-4-carboxylic acid Openeye Name: 2-[3-cyano-5-(2-methoxyethoxy)-4-(4-methoxyphenyl)phenyl]-5-hydroxy-pyridine-4-carboxylic acid CAS Name: 2-[3-cyano-5-(2-methoxyethoxy)-4-(4-methoxyphenyl)phenyl]-5-hydroxy-4-pyridinecarboxylic acid IUPAC Name: 2-[3-cyano-5-(2-methoxyethoxy)-4-(4-methoxyphenyl)phenyl]-5-hydroxypyridine-4-carboxylic acid Traditional Name: 2-[3-cyano-5-(2-methoxyethoxy)-4-(4-methoxyphenyl)phenyl]-5-hydroxy-isonicotinic acid Formula: C23H20N2O6 MolecularWeight: 420.4147

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C(=CC(=C1)C2=NC=C(C(=C2)C(=O)O)O)C#N)C3=CC=C(C=C3)OC

Isomeric SMILES

COCCOC1=C(C(=CC(=C1)C2=NC=C(C(=C2)C(=O)O)O)C#N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H20N2O6/c1-29-7-8-31-21-10-15(19-11-18(23(27)28)20(26)13-25-19)9-16(12-24)22(21)14-3-5-17(30-2)6-4-14/h3-6,9-11,13,26H,7-8H2,1-2H3,(H,27,28)