2-methyl-2-[4-(3-oxidanylprop-1-ynyl)phenoxy]propanoic acid

Systemtic Name: 2-methyl-2-[4-(3-oxidanylprop-1-ynyl)phenoxy]propanoic acid Openeye Name: 2-[4-(3-hydroxyprop-1-ynyl)phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-(3-hydroxyprop-1-ynyl)phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-(3-hydroxyprop-1-ynyl)phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-(3-hydroxyprop-1-ynyl)phenoxy]-2-methyl-propionic acid Formula: C13H14O4 MolecularWeight: 235.240515

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=C(C=C1)C#CCO

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)C#C[13CH2]O

InChI

InChI=1S/C13H14O4/c1-13(2,12(15)16)17-11-7-5-10(6-8-11)4-3-9-14/h5-8,14H,9H2,1-2H3,(H,15,16)/i9+1