5-[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-5-oxo-pentanoic acid CAS Name: 5-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-5-oxopentanoic acid IUPAC Name: 5-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-5-oxopentanoic acid Traditional Name: 5-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-5-keto-valeric acid Formula: C12H11F2NO5 MolecularWeight: 287.216246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)CCCC(=O)O)OC(O2)(F)F

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)CCCC(=O)O)OC(O2)(F)F

InChI

InChI=1S/C12H11F2NO5/c13-12(14)19-8-5-4-7(6-9(8)20-12)15-10(16)2-1-3-11(17)18/h4-6H,1-3H2,(H,15,16)(H,17,18)