ethanoyl ethanoate; 4-methylbenzenesulfonic acid

Systemtic Name: ethanoyl ethanoate; 4-methylbenzenesulfonic acid Openeye Name: acetyl acetate; 4-methylbenzenesulfonic acid CAS Name: acetic acid acetyl ester; 4-methylbenzenesulfonic acid IUPAC Name: acetyl acetate; 4-methylbenzenesulfonic acid Traditional Name: acetic acid acetyl ester; tosylic acid Formula: C11H14O6S MolecularWeight: 274.29026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CC(=O)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CC(=O)OC(=O)C

InChI

InChI=1S/C7H8O3S.C4H6O3/c1-6-2-4-7(5-3-6)11(8,9)10;1-3(5)7-4(2)6/h2-5H,1H3,(H,8,9,10);1-2H3