4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4,4-bis(fluoranyl)butanoate

Systemtic Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4,4-bis(fluoranyl)butanoate Openeye Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4,4-difluoro-butanoate CAS Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4,4-difluorobutanoate IUPAC Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4,4-difluorobutanoate Traditional Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4,4-difluoro-butyrate Formula: C13H13F2O4- MolecularWeight: 271.236726

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(CCC(=O)[O-])(F)F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(CCC(=O)[O-])(F)F)OC1

InChI

InChI=1S/C13H14F2O4/c14-13(15,5-4-12(16)17)9-2-3-10-11(8-9)19-7-1-6-18-10/h2-3,8H,1,4-7H2,(H,16,17)/p-1