4-(3,3-diethoxyprop-1-ynyl)pyridine-2-carboxylic acid

Systemtic Name: 4-(3,3-diethoxyprop-1-ynyl)pyridine-2-carboxylic acid Openeye Name: 4-(3,3-diethoxyprop-1-ynyl)pyridine-2-carboxylic acid CAS Name: 4-(3,3-diethoxyprop-1-ynyl)-2-pyridinecarboxylic acid IUPAC Name: 4-(3,3-diethoxyprop-1-ynyl)pyridine-2-carboxylic acid Traditional Name: 4-(3,3-diethoxyprop-1-ynyl)picolinic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C#CC1=CC(=NC=C1)C(=O)O)OCC

Isomeric SMILES

CCOC(C#CC1=CC(=NC=C1)C(=O)O)OCC

InChI

InChI=1S/C13H15NO4/c1-3-17-12(18-4-2)6-5-10-7-8-14-11(9-10)13(15)16/h7-9,12H,3-4H2,1-2H3,(H,15,16)