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

Systemtic Name: 2-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-N-[(4-methoxyphenyl)methyl]-4-methyl-benzamide Openeye Name: N-[(4-methoxyphenyl)methyl]-4-methyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-benzamide CAS Name: N-[(4-methoxyphenyl)methyl]-4-methyl-2-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]benzamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-4-methyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzamide Traditional Name: 4-methyl-N-p-anisyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-benzamide Formula: C22H27NO8 MolecularWeight: 433.45168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NCC2=CC=C(C=C2)OC)OC3C(C(C(C(O3)CO)O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NCC2=CC=C(C=C2)OC)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O

InChI

InChI=1S/C22H27NO8/c1-12-3-8-15(21(28)23-10-13-4-6-14(29-2)7-5-13)16(9-12)30-22-20(27)19(26)18(25)17(11-24)31-22/h3-9,17-20,22,24-27H,10-11H2,1-2H3,(H,23,28)/t17-,18-,19+,20-,22-/m1/s1