3-[3-(2-methyl-3-oxidanylidene-butan-2-yl)oxyphenyl]propanoic acid

Systemtic Name: 3-[3-(2-methyl-3-oxidanylidene-butan-2-yl)oxyphenyl]propanoic acid Openeye Name: 3-[3-(1,1-dimethyl-2-oxo-propoxy)phenyl]propanoic acid CAS Name: 3-[3-(2-methyl-3-oxobutan-2-yl)oxyphenyl]propanoic acid IUPAC Name: 3-[3-(2-methyl-3-oxobutan-2-yl)oxyphenyl]propanoic acid Traditional Name: 3-[3-(2-keto-1,1-dimethyl-propoxy)phenyl]propionic acid Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C)OC1=CC=CC(=C1)CCC(=O)O

Isomeric SMILES

CC(=O)C(C)(C)OC1=CC=CC(=C1)CCC(=O)O

InChI

InChI=1S/C14H18O4/c1-10(15)14(2,3)18-12-6-4-5-11(9-12)7-8-13(16)17/h4-6,9H,7-8H2,1-3H3,(H,16,17)