4-[(2S)-butan-2-yl]oxy-3,5-dimethyl-benzoate

Systemtic Name: 4-[(2S)-butan-2-yl]oxy-3,5-dimethyl-benzoate Openeye Name: 3,5-dimethyl-4-[(1S)-1-methylpropoxy]benzoate CAS Name: 4-[(2S)-butan-2-yl]oxy-3,5-dimethylbenzoate IUPAC Name: 4-[(2S)-butan-2-yl]oxy-3,5-dimethylbenzoate Traditional Name: 3,5-dimethyl-4-[(1S)-1-methylpropoxy]benzoate Formula: C13H17O3- MolecularWeight: 221.27228

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C=C(C=C1C)C(=O)[O-])C

Isomeric SMILES

CC[C@H](C)OC1=C(C=C(C=C1C)C(=O)[O-])C

InChI

InChI=1S/C13H18O3/c1-5-10(4)16-12-8(2)6-11(13(14)15)7-9(12)3/h6-7,10H,5H2,1-4H3,(H,14,15)/p-1/t10-/m0/s1