(2S)-2-(2,5-dimethoxyphenyl)-3-methyl-butanoate

Systemtic Name: (2S)-2-(2,5-dimethoxyphenyl)-3-methyl-butanoate Openeye Name: (2S)-2-(2,5-dimethoxyphenyl)-3-methyl-butanoate CAS Name: (2S)-2-(2,5-dimethoxyphenyl)-3-methylbutanoate IUPAC Name: (2S)-2-(2,5-dimethoxyphenyl)-3-methylbutanoate Traditional Name: (2S)-2-(2,5-dimethoxyphenyl)-3-methyl-butyrate Formula: C13H17O4- MolecularWeight: 237.27168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=C(C=CC(=C1)OC)OC)C(=O)[O-]

Isomeric SMILES

CC(C)[C@@H](C1=C(C=CC(=C1)OC)OC)C(=O)[O-]

InChI

InChI=1S/C13H18O4/c1-8(2)12(13(14)15)10-7-9(16-3)5-6-11(10)17-4/h5-8,12H,1-4H3,(H,14,15)/p-1/t12-/m0/s1