phenyl 4-methyl-2-oxidanyl-pentanoate

Systemtic Name: phenyl 4-methyl-2-oxidanyl-pentanoate Openeye Name: phenyl 2-hydroxy-4-methyl-pentanoate CAS Name: 2-hydroxy-4-methylpentanoic acid phenyl ester IUPAC Name: phenyl 2-hydroxy-4-methylpentanoate Traditional Name: 2-hydroxy-4-methyl-valeric acid phenyl ester Formula: C12H16O3 MolecularWeight: 208.25364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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