2-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-N-[(4-methoxyphenyl)methyl]-6-oxidanyl-benzamide

Systemtic Name: 2-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-N-[(4-methoxyphenyl)methyl]-6-oxidanyl-benzamide Openeye Name: 2-hydroxy-N-[(4-methoxyphenyl)methyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-benzamide CAS Name: 2-hydroxy-N-[(4-methoxyphenyl)methyl]-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]benzamide IUPAC Name: 2-hydroxy-N-[(4-methoxyphenyl)methyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzamide Traditional Name: 2-hydroxy-N-p-anisyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-benzamide Formula: C21H25NO9 MolecularWeight: 435.4245

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2=C(C=CC=C2OC3C(C(C(C(O3)CO)O)O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2=C(C=CC=C2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O

InChI

InChI=1S/C21H25NO9/c1-29-12-7-5-11(6-8-12)9-22-20(28)16-13(24)3-2-4-14(16)30-21-19(27)18(26)17(25)15(10-23)31-21/h2-8,15,17-19,21,23-27H,9-10H2,1H3,(H,22,28)/t15-,17-,18+,19-,21-/m1/s1