(2-ethanoyl-2,4,4-trimethyl-3-oxidanylidene-pentyl) (4-methylphenyl) sulfite

Systemtic Name: (2-ethanoyl-2,4,4-trimethyl-3-oxidanylidene-pentyl) (4-methylphenyl) sulfite Openeye Name: (2-acetyl-2,4,4-trimethyl-3-oxo-pentyl) p-tolyl sulfite CAS Name: sulfurous acid (2-acetyl-2,4,4-trimethyl-3-oxopentyl) (4-methylphenyl) ester IUPAC Name: (2-acetyl-2,4,4-trimethyl-3-oxopentyl) (4-methylphenyl) sulfite Traditional Name: sulfurous acid (2-acetyl-3-keto-2,4,4-trimethyl-pentyl) p-tolyl ester Formula: C17H24O5S MolecularWeight: 340.43446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OS(=O)OCC(C)(C(=O)C)C(=O)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)OS(=O)OCC(C)(C(=O)C)C(=O)C(C)(C)C

InChI

InChI=1S/C17H24O5S/c1-12-7-9-14(10-8-12)22-23(20)21-11-17(6,13(2)18)15(19)16(3,4)5/h7-10H,11H2,1-6H3