4-ethyl-6-[[2-oxidanyl-4-phenyl-2-(trifluoromethyl)pentyl]amino]-2,3-benzoxazin-1-one

Systemtic Name: 4-ethyl-6-[[2-oxidanyl-4-phenyl-2-(trifluoromethyl)pentyl]amino]-2,3-benzoxazin-1-one Openeye Name: 4-ethyl-6-[[2-hydroxy-4-phenyl-2-(trifluoromethyl)pentyl]amino]-2,3-benzoxazin-1-one CAS Name: 4-ethyl-6-[[2-hydroxy-4-phenyl-2-(trifluoromethyl)pentyl]amino]-2,3-benzoxazin-1-one IUPAC Name: 4-ethyl-6-[[2-hydroxy-4-phenyl-2-(trifluoromethyl)pentyl]amino]-2,3-benzoxazin-1-one Traditional Name: 4-ethyl-6-[[2-hydroxy-4-phenyl-2-(trifluoromethyl)pentyl]amino]-2,3-benzoxazin-1-one Formula: C22H23F3N2O3 MolecularWeight: 420.42483

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=O)C2=C1C=C(C=C2)NCC(CC(C)C3=CC=CC=C3)(C(F)(F)F)O

Isomeric SMILES

CCC1=NOC(=O)C2=C1C=C(C=C2)NCC(CC(C)C3=CC=CC=C3)(C(F)(F)F)O

InChI

InChI=1S/C22H23F3N2O3/c1-3-19-18-11-16(9-10-17(18)20(28)30-27-19)26-13-21(29,22(23,24)25)12-14(2)15-7-5-4-6-8-15/h4-11,14,26,29H,3,12-13H2,1-2H3