butyl 4-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3-oxidanyl-benzoate

Systemtic Name: butyl 4-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3-oxidanyl-benzoate Openeye Name: butyl 3-hydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-benzoate CAS Name: 3-hydroxy-4-[[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]benzoic acid butyl ester IUPAC Name: butyl 3-hydroxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoate Traditional Name: 3-hydroxy-4-(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)oxy-benzoic acid butyl ester Formula: C17H24O9 MolecularWeight: 372.36706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O)O

Isomeric SMILES

CCCCOC(=O)C1=CC(=C(C=C1)OC2C(C(C(C(O2)CO)O)O)O)O

InChI

InChI=1S/C17H24O9/c1-2-3-6-24-16(23)9-4-5-11(10(19)7-9)25-17-15(22)14(21)13(20)12(8-18)26-17/h4-5,7,12-15,17-22H,2-3,6,8H2,1H3