2-(2,3,5-trimethylphenoxy)pyridine-3-carboxylate

Systemtic Name: 2-(2,3,5-trimethylphenoxy)pyridine-3-carboxylate Openeye Name: 2-(2,3,5-trimethylphenoxy)pyridine-3-carboxylate CAS Name: 2-(2,3,5-trimethylphenoxy)-3-pyridinecarboxylate IUPAC Name: 2-(2,3,5-trimethylphenoxy)pyridine-3-carboxylate Traditional Name: 2-(2,3,5-trimethylphenoxy)nicotinate Formula: C15H14NO3- MolecularWeight: 256.27656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC2=C(C=CC=N2)C(=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC2=C(C=CC=N2)C(=O)[O-])C)C

InChI

InChI=1S/C15H15NO3/c1-9-7-10(2)11(3)13(8-9)19-14-12(15(17)18)5-4-6-16-14/h4-8H,1-3H3,(H,17,18)/p-1