8-[2-[[1-(3-chloranyl-4-fluoranyl-phenyl)-2-methyl-propan-2-yl]amino]-1-oxidanyl-ethyl]-6-oxidanyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 8-[2-[[1-(3-chloranyl-4-fluoranyl-phenyl)-2-methyl-propan-2-yl]amino]-1-oxidanyl-ethyl]-6-oxidanyl-4H-1,4-benzoxazin-3-one Openeye Name: 8-[2-[[2-(3-chloro-4-fluoro-phenyl)-1,1-dimethyl-ethyl]amino]-1-hydroxy-ethyl]-6-hydroxy-4H-1,4-benzoxazin-3-one CAS Name: 8-[2-[[1-(3-chloro-4-fluorophenyl)-2-methylpropan-2-yl]amino]-1-hydroxyethyl]-6-hydroxy-4H-1,4-benzoxazin-3-one IUPAC Name: 8-[2-[[1-(3-chloro-4-fluorophenyl)-2-methylpropan-2-yl]amino]-1-hydroxyethyl]-6-hydroxy-4H-1,4-benzoxazin-3-one Traditional Name: 8-[2-[[2-(3-chloro-4-fluoro-phenyl)-1,1-dimethyl-ethyl]amino]-1-hydroxy-ethyl]-6-hydroxy-4H-1,4-benzoxazin-3-one Formula: C20H22ClFN2O4 MolecularWeight: 408.851083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC(=C(C=C1)F)Cl)NCC(C2=CC(=CC3=C2OCC(=O)N3)O)O

Isomeric SMILES

CC(C)(CC1=CC(=C(C=C1)F)Cl)NCC(C2=CC(=CC3=C2OCC(=O)N3)O)O

InChI

InChI=1S/C20H22ClFN2O4/c1-20(2,8-11-3-4-15(22)14(21)5-11)23-9-17(26)13-6-12(25)7-16-19(13)28-10-18(27)24-16/h3-7,17,23,25-26H,8-10H2,1-2H3,(H,24,27)