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2-[(5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methylsulfanyl]pyridine-3-carboxylic acid

2-[(5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methylsulfanyl]pyridine-3-carboxylic acid

Systemtic Name:2-[(5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methylsulfanyl]pyridine-3-carboxylic acid
Openeye Name:2-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methylsulfanyl]pyridine-3-carboxylic acid
CAS Name:2-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methylthio]-3-pyridinecarboxylic acid
IUPAC Name:2-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methylsulfanyl]pyridine-3-carboxylic acid
Traditional Name:2-[(2-keto-5-methyl-1,3-dioxol-4-yl)methylthio]nicotinic acid
Formula: C11H9NO5S
MolecularWeight: 267.25786
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=O)O1)CSC2=C(C=CC=N2)C(=O)O


Isomeric SMILES

CC1=C(OC(=O)O1)CSC2=C(C=CC=N2)C(=O)O


InChI

InChI=1S/C11H9NO5S/c1-6-8(17-11(15)16-6)5-18-9-7(10(13)14)3-2-4-12-9/h2-4H,5H2,1H3,(H,13,14)


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