3,3-dimethyl-5-oxidanylidene-5-phenoxy-pentanoic acid

Systemtic Name: 3,3-dimethyl-5-oxidanylidene-5-phenoxy-pentanoic acid Openeye Name: 3,3-dimethyl-5-oxo-5-phenoxy-pentanoic acid CAS Name: 3,3-dimethyl-5-oxo-5-phenoxypentanoic acid IUPAC Name: 3,3-dimethyl-5-oxo-5-phenoxypentanoic acid Traditional Name: 5-keto-3,3-dimethyl-5-phenoxy-valeric acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O4/c1-13(2,8-11(14)15)9-12(16)17-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,14,15)