(2S)-2-(5-methyl-2-propan-2-yl-phenoxy)butanoate

Systemtic Name: (2S)-2-(5-methyl-2-propan-2-yl-phenoxy)butanoate Openeye Name: (2S)-2-(2-isopropyl-5-methyl-phenoxy)butanoate CAS Name: (2S)-2-(5-methyl-2-propan-2-ylphenoxy)butanoate IUPAC Name: (2S)-2-(5-methyl-2-propan-2-ylphenoxy)butanoate Traditional Name: (2S)-2-(2-isopropyl-5-methyl-phenoxy)butyrate Formula: C14H19O3- MolecularWeight: 235.29886

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])OC1=C(C=CC(=C1)C)C(C)C

Isomeric SMILES

CC[C@@H](C(=O)[O-])OC1=C(C=CC(=C1)C)C(C)C

InChI

InChI=1S/C14H20O3/c1-5-12(14(15)16)17-13-8-10(4)6-7-11(13)9(2)3/h6-9,12H,5H2,1-4H3,(H,15,16)/p-1/t12-/m0/s1