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2-(4-oxidanyl-4-oxidanylidene-butyl)sulfanylpyridine-3-carboxylic acid

2-(4-oxidanyl-4-oxidanylidene-butyl)sulfanylpyridine-3-carboxylic acid

Systemtic Name:2-(4-oxidanyl-4-oxidanylidene-butyl)sulfanylpyridine-3-carboxylic acid
Openeye Name:2-(4-hydroxy-4-oxo-butyl)sulfanylpyridine-3-carboxylic acid
CAS Name:2-[(4-hydroxy-4-oxobutyl)thio]-3-pyridinecarboxylic acid
IUPAC Name:2-(4-hydroxy-4-oxobutyl)sulfanylpyridine-3-carboxylic acid
Traditional Name:2-[(4-hydroxy-4-keto-butyl)thio]nicotinic acid
Formula: C10H11NO4S
MolecularWeight: 241.26364
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCCCC(=O)O)C(=O)O


Isomeric SMILES

C1=CC(=C(N=C1)SCCCC(=O)O)C(=O)O


InChI

InChI=1S/C10H11NO4S/c12-8(13)4-2-6-16-9-7(10(14)15)3-1-5-11-9/h1,3,5H,2,4,6H2,(H,12,13)(H,14,15)


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