[4,5-diacetyloxy-6-carbamimidoylsulfanyl-2-(methoxymethyl)oxan-3-yl] ethanoate hydrobromide

Systemtic Name: [4,5-diacetyloxy-6-carbamimidoylsulfanyl-2-(methoxymethyl)oxan-3-yl] ethanoate hydrobromide Openeye Name: [4,5-diacetoxy-6-carbamimidoylsulfanyl-2-(methoxymethyl)tetrahydropyran-3-yl] acetate hydrobromide CAS Name: acetic acid [4,5-diacetyloxy-6-(carbamimidoylthio)-2-(methoxymethyl)-3-oxanyl] ester hydrobromide IUPAC Name: [4,5-diacetyloxy-6-carbamimidoylsulfanyl-2-(methoxymethyl)oxan-3-yl] acetate hydrobromide Traditional Name: acetic acid [4,5-diacetoxy-6-(amidinothio)-2-(methoxymethyl)tetrahydropyran-3-yl] ester hydrobromide Formula: C14H23BrN2O8S MolecularWeight: 459.31002

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(OC(C(C1OC(=O)C)OC(=O)C)SC(=N)N)COC.Br

Isomeric SMILES

CC(=O)OC1C(OC(C(C1OC(=O)C)OC(=O)C)SC(=N)N)COC.Br

InChI

InChI=1S/C14H22N2O8S.BrH/c1-6(17)21-10-9(5-20-4)24-13(25-14(15)16)12(23-8(3)19)11(10)22-7(2)18;/h9-13H,5H2,1-4H3,(H3,15,16);1H