4-(2-butan-2-ylsulfanylethyl)pyridine; ethanedioate

Systemtic Name: 4-(2-butan-2-ylsulfanylethyl)pyridine; ethanedioate Openeye Name: oxalate; 4-(2-sec-butylsulfanylethyl)pyridine CAS Name: 4-[2-(butan-2-ylthio)ethyl]pyridine; oxalate IUPAC Name: 4-(2-butan-2-ylsulfanylethyl)pyridine; oxalate Traditional Name: oxalate; 4-[2-(sec-butylthio)ethyl]pyridine Formula: C13H17NO4S-2 MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SCCC1=CC=NC=C1.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CCC(C)SCCC1=CC=NC=C1.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C11H17NS.C2H2O4/c1-3-10(2)13-9-6-11-4-7-12-8-5-11;3-1(4)2(5)6/h4-5,7-8,10H,3,6,9H2,1-2H3;(H,3,4)(H,5,6)/p-2