6-carboxyoxyheptan-2-yl hydrogen carbonate

Systemtic Name: 6-carboxyoxyheptan-2-yl hydrogen carbonate Openeye Name: (5-carboxyoxy-1-methyl-hexyl) hydrogen carbonate CAS Name: carbonic acid 6-carboxyoxyheptan-2-yl ester IUPAC Name: 6-carboxyoxyheptan-2-yl hydrogen carbonate Traditional Name: carbonic acid (5-carboxyoxy-1-methyl-hexyl) ester Formula: C9H16O6 MolecularWeight: 220.21974

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)OC(=O)O)OC(=O)O

Isomeric SMILES

CC(CCCC(C)OC(=O)O)OC(=O)O

InChI

InChI=1S/C9H16O6/c1-6(14-8(10)11)4-3-5-7(2)15-9(12)13/h6-7H,3-5H2,1-2H3,(H,10,11)(H,12,13)