1,3,4,5,6-pentakis(oxidanyl)hexan-2-one; phenylmethoxymethylbenzene

Systemtic Name: 1,3,4,5,6-pentakis(oxidanyl)hexan-2-one; phenylmethoxymethylbenzene Openeye Name: benzyloxymethylbenzene; 1,3,4,5,6-pentahydroxyhexan-2-one CAS Name: 1,3,4,5,6-pentahydroxy-2-hexanone; phenylmethoxymethylbenzene IUPAC Name: 1,3,4,5,6-pentahydroxyhexan-2-one; phenylmethoxymethylbenzene Traditional Name: benzoxymethylbenzene; 1,3,4,5,6-pentahydroxyhexan-2-one Formula: C20H26O7 MolecularWeight: 378.41624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2=CC=CC=C2.C(C(C(C(C(=O)CO)O)O)O)O

Isomeric SMILES

C1=CC=C(C=C1)COCC2=CC=CC=C2.C(C(C(C(C(=O)CO)O)O)O)O

InChI

InChI=1S/C14H14O.C6H12O6/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14;7-1-3(9)5(11)6(12)4(10)2-8/h1-10H,11-12H2;3,5-9,11-12H,1-2H2