[4-butoxy-2-(butoxymethyl)-5-sulfanyl-oxolan-3-yl] nitrate

Systemtic Name: [4-butoxy-2-(butoxymethyl)-5-sulfanyl-oxolan-3-yl] nitrate Openeye Name: [4-butoxy-2-(butoxymethyl)-5-sulfanyl-tetrahydrofuran-3-yl] nitrate CAS Name: nitric acid [4-butoxy-2-(butoxymethyl)-5-mercapto-3-oxolanyl] ester IUPAC Name: [4-butoxy-2-(butoxymethyl)-5-sulfanyloxolan-3-yl] nitrate Traditional Name: nitric acid [4-butoxy-2-(butoxymethyl)-5-mercapto-tetrahydrofuran-3-yl] ester Formula: C13H25NO6S MolecularWeight: 323.4057

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC1C(C(C(O1)S)OCCCC)O[N+](=O)[O-]

Isomeric SMILES

CCCCOCC1C(C(C(O1)S)OCCCC)O[N+](=O)[O-]

InChI

InChI=1S/C13H25NO6S/c1-3-5-7-17-9-10-11(20-14(15)16)12(13(21)19-10)18-8-6-4-2/h10-13,21H,3-9H2,1-2H3