phenacyl butanoate

Systemtic Name: phenacyl butanoate Openeye Name: phenacyl butanoate CAS Name: butanoic acid phenacyl ester IUPAC Name: phenacyl butanoate Traditional Name: butyric acid phenacyl ester Formula: C12H14O3 MolecularWeight: 206.23776

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCC(=O)OCC(=O)C1=CC=CC=C1

InChI

InChI=1S/C12H14O3/c1-2-6-12(14)15-9-11(13)10-7-4-3-5-8-10/h3-5,7-8H,2,6,9H2,1H3