3-[3,5-bis(fluoranyl)phenoxy]-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; but-3-ynyl N-chloranyl-N-ethyl-carbamate

Systemtic Name: 3-[3,5-bis(fluoranyl)phenoxy]-7-oxabicyclo[2.2.1]hepta-1,3,5-triene; but-3-ynyl N-chloranyl-N-ethyl-carbamate Openeye Name: but-3-ynyl N-chloro-N-ethyl-carbamate; 3-(3,5-difluorophenoxy)-7-oxabicyclo[2.2.1]hepta-1,3,5-triene CAS Name: N-chloro-N-ethylcarbamic acid but-3-ynyl ester; 3-(3,5-difluorophenoxy)-7-oxabicyclo[2.2.1]hepta-1,3,5-triene IUPAC Name: but-3-ynyl N-chloro-N-ethylcarbamate; 3-(3,5-difluorophenoxy)-7-oxabicyclo[2.2.1]hepta-1,3,5-triene Traditional Name: N-chloro-N-ethyl-carbamic acid but-3-ynyl ester; 3-(3,5-difluorophenoxy)-7-oxabicyclo[2.2.1]hepta-1,3,5-triene Formula: C19H16ClF2NO4 MolecularWeight: 395.784446

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)OCCC#C)Cl.C1=CC2=C(C=C1O2)OC3=CC(=CC(=C3)F)F

Isomeric SMILES

CCN(C(=O)OCCC#C)Cl.C1=CC2=C(C=C1O2)OC3=CC(=CC(=C3)F)F

InChI

InChI=1S/C12H6F2O2.C7H10ClNO2/c13-7-3-8(14)5-10(4-7)16-12-6-9-1-2-11(12)15-9;1-3-5-6-11-7(10)9(8)4-2/h1-6H;1H,4-6H2,2H3