6-[[4-[2-(6-fluoranyl-2-methyl-quinolin-5-yl)oxyethyl]piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[[4-[2-(6-fluoranyl-2-methyl-quinolin-5-yl)oxyethyl]piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[[4-[2-[(6-fluoro-2-methyl-5-quinolyl)oxy]ethyl]piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[[4-[2-[(6-fluoro-2-methyl-5-quinolinyl)oxy]ethyl]-1-piperazinyl]methyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[[4-[2-(6-fluoro-2-methylquinolin-5-yl)oxyethyl]piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[[4-[2-[(6-fluoro-2-methyl-5-quinolyl)oxy]ethyl]piperazino]methyl]-4H-1,4-benzoxazin-3-one Formula: C25H27FN4O3 MolecularWeight: 450.505283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=C(C=C2)F)OCCN3CCN(CC3)CC4=CC5=C(C=C4)OCC(=O)N5

Isomeric SMILES

CC1=NC2=C(C=C1)C(=C(C=C2)F)OCCN3CCN(CC3)CC4=CC5=C(C=C4)OCC(=O)N5

InChI

InChI=1S/C25H27FN4O3/c1-17-2-4-19-21(27-17)6-5-20(26)25(19)32-13-12-29-8-10-30(11-9-29)15-18-3-7-23-22(14-18)28-24(31)16-33-23/h2-7,14H,8-13,15-16H2,1H3,(H,28,31)