2-ethyl-2-oxidanyl-4-phenyl-butanoate

Systemtic Name: 2-ethyl-2-oxidanyl-4-phenyl-butanoate Openeye Name: 2-ethyl-2-hydroxy-4-phenyl-butanoate CAS Name: 2-ethyl-2-hydroxy-4-phenylbutanoate IUPAC Name: 2-ethyl-2-hydroxy-4-phenylbutanoate Traditional Name: 2-ethyl-2-hydroxy-4-phenyl-butyrate Formula: C12H15O3- MolecularWeight: 207.2457

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC=CC=C1)(C(=O)[O-])O

Isomeric SMILES

CCC(CCC1=CC=CC=C1)(C(=O)[O-])O

InChI

InChI=1S/C12H16O3/c1-2-12(15,11(13)14)9-8-10-6-4-3-5-7-10/h3-7,15H,2,8-9H2,1H3,(H,13,14)/p-1