2-[2-(2-chloranylphenoxy)ethylsulfanyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[2-(2-chloranylphenoxy)ethylsulfanyl]pyridine-3-carboxylic acid Openeye Name: 2-[2-(2-chlorophenoxy)ethylsulfanyl]pyridine-3-carboxylic acid CAS Name: 2-[2-(2-chlorophenoxy)ethylthio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-(2-chlorophenoxy)ethylsulfanyl]pyridine-3-carboxylic acid Traditional Name: 2-[2-(2-chlorophenoxy)ethylthio]nicotinic acid Formula: C14H12ClNO3S MolecularWeight: 309.76798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCCSC2=C(C=CC=N2)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)OCCSC2=C(C=CC=N2)C(=O)O)Cl

InChI

InChI=1S/C14H12ClNO3S/c15-11-5-1-2-6-12(11)19-8-9-20-13-10(14(17)18)4-3-7-16-13/h1-7H,8-9H2,(H,17,18)