2-[[4-methoxy-2-(methoxymethoxy)phenyl]methylsulfanyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[[4-methoxy-2-(methoxymethoxy)phenyl]methylsulfanyl]pyridine-3-carboxylic acid Openeye Name: 2-[[4-methoxy-2-(methoxymethoxy)phenyl]methylsulfanyl]pyridine-3-carboxylic acid CAS Name: 2-[[4-methoxy-2-(methoxymethoxy)phenyl]methylthio]-3-pyridinecarboxylic acid IUPAC Name: 2-[[4-methoxy-2-(methoxymethoxy)phenyl]methylsulfanyl]pyridine-3-carboxylic acid Traditional Name: 2-[[4-methoxy-2-(methoxymethoxy)benzyl]thio]nicotinic acid Formula: C16H17NO5S MolecularWeight: 335.37488

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Descriptors Computed from Structure

Canonical SMILES:

COCOC1=C(C=CC(=C1)OC)CSC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

COCOC1=C(C=CC(=C1)OC)CSC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C16H17NO5S/c1-20-10-22-14-8-12(21-2)6-5-11(14)9-23-15-13(16(18)19)4-3-7-17-15/h3-8H,9-10H2,1-2H3,(H,18,19)