6-[3,5-bis(trifluoromethyl)phenyl]-4,4-dimethyl-1H-3,1-benzoxazin-2-one

Systemtic Name: 6-[3,5-bis(trifluoromethyl)phenyl]-4,4-dimethyl-1H-3,1-benzoxazin-2-one Openeye Name: 6-[3,5-bis(trifluoromethyl)phenyl]-4,4-dimethyl-1H-3,1-benzoxazin-2-one CAS Name: 6-[3,5-bis(trifluoromethyl)phenyl]-4,4-dimethyl-1H-3,1-benzoxazin-2-one IUPAC Name: 6-[3,5-bis(trifluoromethyl)phenyl]-4,4-dimethyl-1H-3,1-benzoxazin-2-one Traditional Name: 6-[3,5-bis(trifluoromethyl)phenyl]-4,4-dimethyl-1H-3,1-benzoxazin-2-one Formula: C18H13F6NO2 MolecularWeight: 389.291739

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)NC(=O)O1)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)NC(=O)O1)C

InChI

InChI=1S/C18H13F6NO2/c1-16(2)13-7-9(3-4-14(13)25-15(26)27-16)10-5-11(17(19,20)21)8-12(6-10)18(22,23)24/h3-8H,1-2H3,(H,25,26)