(3S)-3-acetyloxy-4,4-dimethyl-5-oxidanylidene-heptanoic acid

Systemtic Name: (3S)-3-acetyloxy-4,4-dimethyl-5-oxidanylidene-heptanoic acid Openeye Name: (3S)-3-acetoxy-4,4-dimethyl-5-oxo-heptanoic acid CAS Name: (3S)-3-acetyloxy-4,4-dimethyl-5-oxoheptanoic acid IUPAC Name: (3S)-3-acetyloxy-4,4-dimethyl-5-oxoheptanoic acid Traditional Name: (3S)-3-acetoxy-5-keto-4,4-dimethyl-enanthic acid Formula: C11H18O5 MolecularWeight: 230.25762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(=O)C(C)(C)[C@H](CC(=O)O)OC(=O)C

InChI

InChI=1S/C11H18O5/c1-5-8(13)11(3,4)9(6-10(14)15)16-7(2)12/h9H,5-6H2,1-4H3,(H,14,15)/t9-/m0/s1