2-(2-ethyl-4-oxidanyl-4-oxidanylidene-butoxy)carbonylbenzoic acid

Systemtic Name: 2-(2-ethyl-4-oxidanyl-4-oxidanylidene-butoxy)carbonylbenzoic acid Openeye Name: 2-(2-ethyl-4-hydroxy-4-oxo-butoxy)carbonylbenzoic acid CAS Name: 2-[(2-ethyl-4-hydroxy-4-oxobutoxy)-oxomethyl]benzoic acid IUPAC Name: 2-(2-ethyl-4-hydroxy-4-oxobutoxy)carbonylbenzoic acid Traditional Name: 2-(2-ethyl-4-hydroxy-4-keto-butoxy)carbonylbenzoic acid Formula: C14H16O6 MolecularWeight: 280.27324

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)O)COC(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CCC(CC(=O)O)COC(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C14H16O6/c1-2-9(7-12(15)16)8-20-14(19)11-6-4-3-5-10(11)13(17)18/h3-6,9H,2,7-8H2,1H3,(H,15,16)(H,17,18)