phenyl 2-ethyl-4,4-dimethyl-3-oxidanyl-pentanoate

Systemtic Name: phenyl 2-ethyl-4,4-dimethyl-3-oxidanyl-pentanoate Openeye Name: phenyl 2-ethyl-3-hydroxy-4,4-dimethyl-pentanoate CAS Name: 2-ethyl-3-hydroxy-4,4-dimethylpentanoic acid phenyl ester IUPAC Name: phenyl 2-ethyl-3-hydroxy-4,4-dimethylpentanoate Traditional Name: 2-ethyl-3-hydroxy-4,4-dimethyl-valeric acid phenyl ester Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22O3/c1-5-12(13(16)15(2,3)4)14(17)18-11-9-7-6-8-10-11/h6-10,12-13,16H,5H2,1-4H3