3-(3-chloranylphenoxy)-5-methoxy-2,4,6-tris(oxidanyl)hexanoic acid

Systemtic Name: 3-(3-chloranylphenoxy)-5-methoxy-2,4,6-tris(oxidanyl)hexanoic acid Openeye Name: 3-(3-chlorophenoxy)-2,4,6-trihydroxy-5-methoxy-hexanoic acid CAS Name: 3-(3-chlorophenoxy)-2,4,6-trihydroxy-5-methoxyhexanoic acid IUPAC Name: 3-(3-chlorophenoxy)-2,4,6-trihydroxy-5-methoxyhexanoic acid Traditional Name: 3-(3-chlorophenoxy)-2,4,6-trihydroxy-5-methoxy-hexanoic acid Formula: C13H17ClO7 MolecularWeight: 320.72288

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Descriptors Computed from Structure

Canonical SMILES:

COC(CO)C(C(C(C(=O)O)O)OC1=CC(=CC=C1)Cl)O

Isomeric SMILES

COC(CO)C(C(C(C(=O)O)O)OC1=CC(=CC=C1)Cl)O

InChI

InChI=1S/C13H17ClO7/c1-20-9(6-15)10(16)12(11(17)13(18)19)21-8-4-2-3-7(14)5-8/h2-5,9-12,15-17H,6H2,1H3,(H,18,19)