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4-ethanoyl-2-methyl-heptanedioic acid

4-ethanoyl-2-methyl-heptanedioic acid

Systemtic Name:4-ethanoyl-2-methyl-heptanedioic acid
Openeye Name:4-acetyl-2-methyl-heptanedioic acid
CAS Name:4-acetyl-2-methylheptanedioic acid
IUPAC Name:4-acetyl-2-methylheptanedioic acid
Traditional Name:4-acetyl-2-methyl-pimelic acid
Formula: C10H16O5
MolecularWeight: 216.23104
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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CCC(=O)O)C(=O)C)C(=O)O


Isomeric SMILES

CC(CC(CCC(=O)O)C(=O)C)C(=O)O


InChI

InChI=1S/C10H16O5/c1-6(10(14)15)5-8(7(2)11)3-4-9(12)13/h6,8H,3-5H2,1-2H3,(H,12,13)(H,14,15)


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