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

Systemtic Name: chloranyl ethanoate; 1,3,4,5,6-pentakis(oxidanyl)hexan-2-one Openeye Name: chloro acetate; 1,3,4,5,6-pentahydroxyhexan-2-one CAS Name: acetic acid chloro ester; 1,3,4,5,6-pentahydroxy-2-hexanone IUPAC Name: chloro acetate; 1,3,4,5,6-pentahydroxyhexan-2-one Traditional Name: acetic acid chloro ester; 1,3,4,5,6-pentahydroxyhexan-2-one Formula: C8H15ClO8 MolecularWeight: 274.6529

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCl.C(C(C(C(C(=O)CO)O)O)O)O

Isomeric SMILES

CC(=O)OCl.C(C(C(C(C(=O)CO)O)O)O)O

InChI

InChI=1S/C6H12O6.C2H3ClO2/c7-1-3(9)5(11)6(12)4(10)2-8;1-2(4)5-3/h3,5-9,11-12H,1-2H2;1H3