methyl 4-(3-oxidanylidenebutanoyl)benzoate

Systemtic Name: methyl 4-(3-oxidanylidenebutanoyl)benzoate Openeye Name: methyl 4-(3-oxobutanoyl)benzoate CAS Name: 4-(1,3-dioxobutyl)benzoic acid methyl ester IUPAC Name: methyl 4-(3-oxobutanoyl)benzoate Traditional Name: 4-acetoacetylbenzoic acid methyl ester Formula: C12H12O4 MolecularWeight: 220.22128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12O4/c1-8(13)7-11(14)9-3-5-10(6-4-9)12(15)16-2/h3-6H,7H2,1-2H3