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

Systemtic Name: 8-[2-[[1-(4-fluoranyl-3-methoxy-phenyl)-2-methyl-propan-2-yl]amino]-1-oxidanyl-ethyl]-6-oxidanyl-4H-1,4-benzoxazin-3-one Openeye Name: 8-[2-[[2-(4-fluoro-3-methoxy-phenyl)-1,1-dimethyl-ethyl]amino]-1-hydroxy-ethyl]-6-hydroxy-4H-1,4-benzoxazin-3-one CAS Name: 8-[2-[[1-(4-fluoro-3-methoxyphenyl)-2-methylpropan-2-yl]amino]-1-hydroxyethyl]-6-hydroxy-4H-1,4-benzoxazin-3-one IUPAC Name: 8-[2-[[1-(4-fluoro-3-methoxyphenyl)-2-methylpropan-2-yl]amino]-1-hydroxyethyl]-6-hydroxy-4H-1,4-benzoxazin-3-one Traditional Name: 8-[2-[[2-(4-fluoro-3-methoxy-phenyl)-1,1-dimethyl-ethyl]amino]-1-hydroxy-ethyl]-6-hydroxy-4H-1,4-benzoxazin-3-one Formula: C21H25FN2O5 MolecularWeight: 404.432003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25FN2O5/c1-21(2,9-12-4-5-15(22)18(6-12)28-3)23-10-17(26)14-7-13(25)8-16-20(14)29-11-19(27)24-16/h4-8,17,23,25-26H,9-11H2,1-3H3,(H,24,27)