diethyl-[6-(oxolan-2-yl)hexyl]sulfanium; pyridine-3-carboxylate

Systemtic Name: diethyl-[6-(oxolan-2-yl)hexyl]sulfanium; pyridine-3-carboxylate Openeye Name: diethyl(6-tetrahydrofuran-2-ylhexyl)sulfonium; pyridine-3-carboxylate CAS Name: diethyl-[6-(2-oxolanyl)hexyl]sulfonium; 3-pyridinecarboxylate IUPAC Name: diethyl-[6-(oxolan-2-yl)hexyl]sulfanium; pyridine-3-carboxylate Traditional Name: diethyl-[6-(tetrahydrofuryl)hexyl]sulfonium; nicotinate Formula: C20H33NO3S MolecularWeight: 367.54592

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Descriptors Computed from Structure

Canonical SMILES:

CC[S+](CC)CCCCCCC1CCCO1.C1=CC(=CN=C1)C(=O)[O-]

Isomeric SMILES

CC[S+](CC)CCCCCCC1CCCO1.C1=CC(=CN=C1)C(=O)[O-]

InChI

InChI=1S/C14H29OS.C6H5NO2/c1-3-16(4-2)13-8-6-5-7-10-14-11-9-12-15-14;8-6(9)5-2-1-3-7-4-5/h14H,3-13H2,1-2H3;1-4H,(H,8,9)/q+1;/p-1