(2R)-3-methyl-2-[(2S)-octan-2-yl]oxy-butanoate

Systemtic Name: (2R)-3-methyl-2-[(2S)-octan-2-yl]oxy-butanoate Openeye Name: (2R)-3-methyl-2-[(1S)-1-methylheptoxy]butanoate CAS Name: (2R)-3-methyl-2-[(2S)-octan-2-yl]oxybutanoate IUPAC Name: (2R)-3-methyl-2-[(2S)-octan-2-yl]oxybutanoate Traditional Name: (2R)-3-methyl-2-[(1S)-1-methylheptoxy]butyrate Formula: C13H25O3- MolecularWeight: 229.3358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(C(C)C)C(=O)[O-]

Isomeric SMILES

CCCCCC[C@H](C)O[C@H](C(C)C)C(=O)[O-]

InChI

InChI=1S/C13H26O3/c1-5-6-7-8-9-11(4)16-12(10(2)3)13(14)15/h10-12H,5-9H2,1-4H3,(H,14,15)/p-1/t11-,12+/m0/s1