2-[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]-1,3-benzoxazole-6-carboxylic acid

Systemtic Name: 2-[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]-1,3-benzoxazole-6-carboxylic acid Openeye Name: 2-(2,2-difluoro-1,3-benzodioxol-4-yl)-1,3-benzoxazole-6-carboxylic acid CAS Name: 2-(2,2-difluoro-1,3-benzodioxol-4-yl)-1,3-benzoxazole-6-carboxylic acid IUPAC Name: 2-(2,2-difluoro-1,3-benzodioxol-4-yl)-1,3-benzoxazole-6-carboxylic acid Traditional Name: 2-(2,2-difluoro-1,3-benzodioxol-4-yl)-1,3-benzoxazole-6-carboxylic acid Formula: C15H7F2NO5 MolecularWeight: 319.216586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)OC(O2)(F)F)C3=NC4=C(O3)C=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC(=C2C(=C1)OC(O2)(F)F)C3=NC4=C(O3)C=C(C=C4)C(=O)O

InChI

InChI=1S/C15H7F2NO5/c16-15(17)22-10-3-1-2-8(12(10)23-15)13-18-9-5-4-7(14(19)20)6-11(9)21-13/h1-6H,(H,19,20)