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

Systemtic Name: 2-[[4-methoxy-2-[2-(methoxymethoxy)ethoxy]phenyl]methylsulfanyl]pyridine-3-carboxylic acid Openeye Name: 2-[[4-methoxy-2-[2-(methoxymethoxy)ethoxy]phenyl]methylsulfanyl]pyridine-3-carboxylic acid CAS Name: 2-[[4-methoxy-2-[2-(methoxymethoxy)ethoxy]phenyl]methylthio]-3-pyridinecarboxylic acid IUPAC Name: 2-[[4-methoxy-2-[2-(methoxymethoxy)ethoxy]phenyl]methylsulfanyl]pyridine-3-carboxylic acid Traditional Name: 2-[[4-methoxy-2-[2-(methoxymethoxy)ethoxy]benzyl]thio]nicotinic acid Formula: C18H21NO6S MolecularWeight: 379.42744

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Descriptors Computed from Structure

Canonical SMILES:

COCOCCOC1=C(C=CC(=C1)OC)CSC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

COCOCCOC1=C(C=CC(=C1)OC)CSC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C18H21NO6S/c1-22-12-24-8-9-25-16-10-14(23-2)6-5-13(16)11-26-17-15(18(20)21)4-3-7-19-17/h3-7,10H,8-9,11-12H2,1-2H3,(H,20,21)