3-methoxycarbonyl-5-methyl-hexanoic acid

Systemtic Name: 3-methoxycarbonyl-5-methyl-hexanoic acid Openeye Name: 3-methoxycarbonyl-5-methyl-hexanoic acid CAS Name: 3-methoxycarbonyl-5-methylhexanoic acid IUPAC Name: 3-methoxycarbonyl-5-methylhexanoic acid Traditional Name: 3-carbomethoxy-5-methyl-hexanoic acid Formula: C9H16O4 MolecularWeight: 188.22094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H16O4/c1-6(2)4-7(5-8(10)11)9(12)13-3/h6-7H,4-5H2,1-3H3,(H,10,11)