4-phenoxybutyl 3-oxidanylidenebutanoate

Systemtic Name: 4-phenoxybutyl 3-oxidanylidenebutanoate Openeye Name: 4-phenoxybutyl 3-oxobutanoate CAS Name: 3-oxobutanoic acid 4-phenoxybutyl ester IUPAC Name: 4-phenoxybutyl 3-oxobutanoate Traditional Name: 3-ketobutyric acid 4-phenoxybutyl ester Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OCCCCOC1=CC=CC=C1

Isomeric SMILES

CC(=O)CC(=O)OCCCCOC1=CC=CC=C1

InChI

InChI=1S/C14H18O4/c1-12(15)11-14(16)18-10-6-5-9-17-13-7-3-2-4-8-13/h2-4,7-8H,5-6,9-11H2,1H3