2-(hydroxymethyl)-6-[2-[(4-nitrophenyl)methyl]thiophen-3-yl]oxy-oxane-3,4,5-triol

Systemtic Name: 2-(hydroxymethyl)-6-[2-[(4-nitrophenyl)methyl]thiophen-3-yl]oxy-oxane-3,4,5-triol Openeye Name: 2-(hydroxymethyl)-6-[[2-[(4-nitrophenyl)methyl]-3-thienyl]oxy]tetrahydropyran-3,4,5-triol CAS Name: 2-(hydroxymethyl)-6-[[2-[(4-nitrophenyl)methyl]-3-thiophenyl]oxy]oxane-3,4,5-triol IUPAC Name: 2-(hydroxymethyl)-6-[2-[(4-nitrophenyl)methyl]thiophen-3-yl]oxyoxane-3,4,5-triol Traditional Name: 2-methylol-6-[[2-(4-nitrobenzyl)-3-thienyl]oxy]tetrahydropyran-3,4,5-triol Formula: C17H19NO8S MolecularWeight: 397.39966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=C(C=CS2)OC3C(C(C(C(O3)CO)O)O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC2=C(C=CS2)OC3C(C(C(C(O3)CO)O)O)O)[N+](=O)[O-]

InChI

InChI=1S/C17H19NO8S/c19-8-12-14(20)15(21)16(22)17(26-12)25-11-5-6-27-13(11)7-9-1-3-10(4-2-9)18(23)24/h1-6,12,14-17,19-22H,7-8H2