ethanoyl ethanoate; methylbenzene

Systemtic Name: ethanoyl ethanoate; methylbenzene Openeye Name: acetyl acetate; toluene CAS Name: acetic acid acetyl ester; toluene IUPAC Name: acetyl acetate; toluene Traditional Name: acetic acid acetyl ester; toluene Formula: C11H14O3 MolecularWeight: 194.22706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8.C4H6O3/c1-7-5-3-2-4-6-7;1-3(5)7-4(2)6/h2-6H,1H3;1-2H3