2-[4-(3-oxidanylidenebutyl)phenoxy]ethanoic acid

Systemtic Name: 2-[4-(3-oxidanylidenebutyl)phenoxy]ethanoic acid Openeye Name: 2-[4-(3-oxobutyl)phenoxy]acetic acid CAS Name: 2-[4-(3-oxobutyl)phenoxy]acetic acid IUPAC Name: 2-[4-(3-oxobutyl)phenoxy]acetic acid Traditional Name: 2-[4-(3-ketobutyl)phenoxy]acetic acid Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC=C(C=C1)OCC(=O)O

Isomeric SMILES

CC(=O)CCC1=CC=C(C=C1)OCC(=O)O

InChI

InChI=1S/C12H14O4/c1-9(13)2-3-10-4-6-11(7-5-10)16-8-12(14)15/h4-7H,2-3,8H2,1H3,(H,14,15)