3-iodanylprop-2-ynyl 2-phenoxybutanoate

Systemtic Name: 3-iodanylprop-2-ynyl 2-phenoxybutanoate Openeye Name: 3-iodoprop-2-ynyl 2-phenoxybutanoate CAS Name: 2-phenoxybutanoic acid 3-iodoprop-2-ynyl ester IUPAC Name: 3-iodoprop-2-ynyl 2-phenoxybutanoate Traditional Name: 2-phenoxybutyric acid 3-iodoprop-2-ynyl ester Formula: C13H13IO3 MolecularWeight: 344.14499

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC#CI)OC1=CC=CC=C1

Isomeric SMILES

CCC(C(=O)OCC#CI)OC1=CC=CC=C1

InChI

InChI=1S/C13H13IO3/c1-2-12(13(15)16-10-6-9-14)17-11-7-4-3-5-8-11/h3-5,7-8,12H,2,10H2,1H3