(2R)-2-[(2S)-2-ethylhexoxy]-3-methyl-butanoate

Systemtic Name: (2R)-2-[(2S)-2-ethylhexoxy]-3-methyl-butanoate Openeye Name: (2R)-2-[(2S)-2-ethylhexoxy]-3-methyl-butanoate CAS Name: (2R)-2-[(2S)-2-ethylhexoxy]-3-methylbutanoate IUPAC Name: (2R)-2-[(2S)-2-ethylhexoxy]-3-methylbutanoate Traditional Name: (2R)-2-[(2S)-2-ethylhexoxy]-3-methyl-butyrate Formula: C13H25O3- MolecularWeight: 229.3358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(C(C)C)C(=O)[O-]

Isomeric SMILES

CCCC[C@H](CC)CO[C@H](C(C)C)C(=O)[O-]

InChI

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