4-[2,5-bis(chloranyl)phenyl]sulfanylpyridine-3-carboxylic acid

Systemtic Name: 4-[2,5-bis(chloranyl)phenyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 4-(2,5-dichlorophenyl)sulfanylpyridine-3-carboxylic acid CAS Name: 4-[(2,5-dichlorophenyl)thio]-3-pyridinecarboxylic acid IUPAC Name: 4-(2,5-dichlorophenyl)sulfanylpyridine-3-carboxylic acid Traditional Name: 4-[(2,5-dichlorophenyl)thio]nicotinic acid Formula: C12H7Cl2NO2S MolecularWeight: 300.16048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)SC2=C(C=NC=C2)C(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1Cl)SC2=C(C=NC=C2)C(=O)O)Cl

InChI

InChI=1S/C12H7Cl2NO2S/c13-7-1-2-9(14)11(5-7)18-10-3-4-15-6-8(10)12(16)17/h1-6H,(H,16,17)