5-methyl-2-(1-oxidanylpropan-2-yl)phenol ethanoate

Systemtic Name: 5-methyl-2-(1-oxidanylpropan-2-yl)phenol ethanoate Openeye Name: 2-(2-hydroxy-1-methyl-ethyl)-5-methyl-phenol acetate CAS Name: 2-(1-hydroxypropan-2-yl)-5-methylphenol acetate IUPAC Name: 2-(1-hydroxypropan-2-yl)-5-methylphenol acetate Traditional Name: 2-(2-hydroxy-1-methyl-ethyl)-5-methyl-phenol acetate Formula: C12H17O4- MolecularWeight: 225.26098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)CO)O.CC(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)CO)O.CC(=O)[O-]

InChI

InChI=1S/C10H14O2.C2H4O2/c1-7-3-4-9(8(2)6-11)10(12)5-7;1-2(3)4/h3-5,8,11-12H,6H2,1-2H3;1H3,(H,3,4)/p-1