2-methylpropyl 2,2,4-trimethyl-3-oxidanyl-pentanoate

Systemtic Name: 2-methylpropyl 2,2,4-trimethyl-3-oxidanyl-pentanoate Openeye Name: isobutyl 3-hydroxy-2,2,4-trimethyl-pentanoate CAS Name: 3-hydroxy-2,2,4-trimethylpentanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-hydroxy-2,2,4-trimethylpentanoate Traditional Name: 3-hydroxy-2,2,4-trimethyl-valeric acid isobutyl ester Formula: C12H24O3 MolecularWeight: 216.31716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(C)(C)C(C(C)C)O

Isomeric SMILES

CC(C)COC(=O)C(C)(C)C(C(C)C)O

InChI

InChI=1S/C12H24O3/c1-8(2)7-15-11(14)12(5,6)10(13)9(3)4/h8-10,13H,7H2,1-6H3