3-[(4-ethanoyl-2-ethyl-5-oxidanyl-phenoxy)methyl]pyridine-2-carboxylic acid

Systemtic Name: 3-[(4-ethanoyl-2-ethyl-5-oxidanyl-phenoxy)methyl]pyridine-2-carboxylic acid Openeye Name: 3-[(4-acetyl-2-ethyl-5-hydroxy-phenoxy)methyl]pyridine-2-carboxylic acid CAS Name: 3-[(4-acetyl-2-ethyl-5-hydroxyphenoxy)methyl]-2-pyridinecarboxylic acid IUPAC Name: 3-[(4-acetyl-2-ethyl-5-hydroxyphenoxy)methyl]pyridine-2-carboxylic acid Traditional Name: 3-[(4-acetyl-2-ethyl-5-hydroxy-phenoxy)methyl]picolinic acid Formula: C17H17NO5 MolecularWeight: 315.32058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C(=O)C)O)OCC2=C(N=CC=C2)C(=O)O

Isomeric SMILES

CCC1=C(C=C(C(=C1)C(=O)C)O)OCC2=C(N=CC=C2)C(=O)O

InChI

InChI=1S/C17H17NO5/c1-3-11-7-13(10(2)19)14(20)8-15(11)23-9-12-5-4-6-18-16(12)17(21)22/h4-8,20H,3,9H2,1-2H3,(H,21,22)