4-[2-[2-(carboxymethyloxy)phenyl]ethynyl]pyridine-2,6-dicarboxylic acid

Systemtic Name: 4-[2-[2-(carboxymethyloxy)phenyl]ethynyl]pyridine-2,6-dicarboxylic acid Openeye Name: 4-[2-[2-(carboxymethyloxy)phenyl]ethynyl]pyridine-2,6-dicarboxylic acid CAS Name: 4-[2-[2-(carboxymethyloxy)phenyl]ethynyl]pyridine-2,6-dicarboxylic acid IUPAC Name: 4-[2-[2-(carboxymethyloxy)phenyl]ethynyl]pyridine-2,6-dicarboxylic acid Traditional Name: 4-[2-[2-(carboxymethyloxy)phenyl]ethynyl]dipicolinic acid Formula: C17H11NO7 MolecularWeight: 341.27174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#CC2=CC(=NC(=C2)C(=O)O)C(=O)O)OCC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C#CC2=CC(=NC(=C2)C(=O)O)C(=O)O)OCC(=O)O

InChI

InChI=1S/C17H11NO7/c19-15(20)9-25-14-4-2-1-3-11(14)6-5-10-7-12(16(21)22)18-13(8-10)17(23)24/h1-4,7-8H,9H2,(H,19,20)(H,21,22)(H,23,24)