4-[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]amino]butanoic acid

Systemtic Name: 4-[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]amino]butanoic acid Openeye Name: 4-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]butanoic acid CAS Name: 4-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]butanoic acid IUPAC Name: 4-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]butanoic acid Traditional Name: 4-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]butyric acid Formula: C11H11F2NO4 MolecularWeight: 259.206146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NCCCC(=O)O)OC(O2)(F)F

Isomeric SMILES

C1=CC2=C(C=C1NCCCC(=O)O)OC(O2)(F)F

InChI

InChI=1S/C11H11F2NO4/c12-11(13)17-8-4-3-7(6-9(8)18-11)14-5-1-2-10(15)16/h3-4,6,14H,1-2,5H2,(H,15,16)