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

Systemtic Name: 2-[3-[(4-ethylphenyl)methyl]benzimidazol-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol Openeye Name: 2-[3-[(4-ethylphenyl)methyl]benzimidazol-4-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol CAS Name: 2-[[3-[(4-ethylphenyl)methyl]-4-benzimidazolyl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol IUPAC Name: 2-[3-[(4-ethylphenyl)methyl]benzimidazol-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol Traditional Name: 2-[3-(4-ethylbenzyl)benzimidazol-4-yl]oxy-6-methylol-tetrahydropyran-3,4,5-triol Formula: C22H26N2O6 MolecularWeight: 414.45164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C=NC3=C2C(=CC=C3)OC4C(C(C(C(O4)CO)O)O)O

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C=NC3=C2C(=CC=C3)OC4C(C(C(C(O4)CO)O)O)O

InChI

InChI=1S/C22H26N2O6/c1-2-13-6-8-14(9-7-13)10-24-12-23-15-4-3-5-16(18(15)24)29-22-21(28)20(27)19(26)17(11-25)30-22/h3-9,12,17,19-22,25-28H,2,10-11H2,1H3