1-[4,4,4-tris(fluoranyl)-3-methyl-butyl]-3,1-benzoxazine-2,4-dione

Systemtic Name: 1-[4,4,4-tris(fluoranyl)-3-methyl-butyl]-3,1-benzoxazine-2,4-dione Openeye Name: 1-(4,4,4-trifluoro-3-methyl-butyl)-3,1-benzoxazine-2,4-dione CAS Name: 1-(4,4,4-trifluoro-3-methylbutyl)-3,1-benzoxazine-2,4-dione IUPAC Name: 1-(4,4,4-trifluoro-3-methylbutyl)-3,1-benzoxazine-2,4-dione Traditional Name: 1-(4,4,4-trifluoro-3-methyl-butyl)-3,1-benzoxazine-2,4-quinone Formula: C13H12F3NO3 MolecularWeight: 287.23449

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1C2=CC=CC=C2C(=O)OC1=O)C(F)(F)F

Isomeric SMILES

CC(CCN1C2=CC=CC=C2C(=O)OC1=O)C(F)(F)F

InChI

InChI=1S/C13H12F3NO3/c1-8(13(14,15)16)6-7-17-10-5-3-2-4-9(10)11(18)20-12(17)19/h2-5,8H,6-7H2,1H3