4-(pentan-3-yloxymethyl)-2-(2,4,6-trimethylphenoxy)pyridine-3-carboxylic acid

Systemtic Name: 4-(pentan-3-yloxymethyl)-2-(2,4,6-trimethylphenoxy)pyridine-3-carboxylic acid Openeye Name: 4-(1-ethylpropoxymethyl)-2-(2,4,6-trimethylphenoxy)pyridine-3-carboxylic acid CAS Name: 4-(pentan-3-yloxymethyl)-2-(2,4,6-trimethylphenoxy)-3-pyridinecarboxylic acid IUPAC Name: 4-(pentan-3-yloxymethyl)-2-(2,4,6-trimethylphenoxy)pyridine-3-carboxylic acid Traditional Name: 4-(1-ethylpropoxymethyl)-2-(2,4,6-trimethylphenoxy)nicotinic acid Formula: C21H27NO4 MolecularWeight: 357.44338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OCC1=C(C(=NC=C1)OC2=C(C=C(C=C2C)C)C)C(=O)O

Isomeric SMILES

CCC(CC)OCC1=C(C(=NC=C1)OC2=C(C=C(C=C2C)C)C)C(=O)O

InChI

InChI=1S/C21H27NO4/c1-6-17(7-2)25-12-16-8-9-22-20(18(16)21(23)24)26-19-14(4)10-13(3)11-15(19)5/h8-11,17H,6-7,12H2,1-5H3,(H,23,24)