ethyl 3-oxidanylidenebutanoate; methylbenzene

Systemtic Name: ethyl 3-oxidanylidenebutanoate; methylbenzene Openeye Name: ethyl 3-oxobutanoate; toluene CAS Name: 3-oxobutanoic acid ethyl ester; toluene IUPAC Name: ethyl 3-oxobutanoate; toluene Traditional Name: 3-ketobutyric acid ethyl ester; toluene Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8.C6H10O3/c1-7-5-3-2-4-6-7;1-3-9-6(8)4-5(2)7/h2-6H,1H3;3-4H2,1-2H3