5-(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5,5-bis(fluoranyl)pentanoic acid

Systemtic Name: 5-(7-bromanyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5,5-bis(fluoranyl)pentanoic acid Openeye Name: 5-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5,5-difluoro-pentanoic acid CAS Name: 5-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5,5-difluoropentanoic acid IUPAC Name: 5-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5,5-difluoropentanoic acid Traditional Name: 5-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5,5-difluoro-valeric acid Formula: C14H15BrF2O4 MolecularWeight: 365.167306

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C(=C2)C(CCCC(=O)O)(F)F)Br)OC1

Isomeric SMILES

C1COC2=C(C=C(C(=C2)C(CCCC(=O)O)(F)F)Br)OC1

InChI

InChI=1S/C14H15BrF2O4/c15-10-8-12-11(20-5-2-6-21-12)7-9(10)14(16,17)4-1-3-13(18)19/h7-8H,1-6H2,(H,18,19)