5-chloranyl-6-[(3-ethynylphenyl)amino]pyridine-3-carboxylic acid

Systemtic Name: 5-chloranyl-6-[(3-ethynylphenyl)amino]pyridine-3-carboxylic acid Openeye Name: 5-chloro-6-(3-ethynylanilino)pyridine-3-carboxylic acid CAS Name: 5-chloro-6-(3-ethynylanilino)-3-pyridinecarboxylic acid IUPAC Name: 5-chloro-6-(3-ethynylanilino)pyridine-3-carboxylic acid Traditional Name: 5-chloro-6-(3-ethynylanilino)nicotinic acid Formula: C14H9ClN2O2 MolecularWeight: 272.68646

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC2=C(C=C(C=N2)C(=O)O)Cl

Isomeric SMILES

C#CC1=CC(=CC=C1)NC2=C(C=C(C=N2)C(=O)O)Cl

InChI

InChI=1S/C14H9ClN2O2/c1-2-9-4-3-5-11(6-9)17-13-12(15)7-10(8-16-13)14(18)19/h1,3-8H,(H,16,17)(H,18,19)