6-[3-[4-(7-fluoranyl-2-methyl-quinolin-5-yl)piperazin-1-yl]propyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-[4-(7-fluoranyl-2-methyl-quinolin-5-yl)piperazin-1-yl]propyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-[4-(7-fluoro-2-methyl-5-quinolyl)piperazin-1-yl]propyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-[4-(7-fluoro-2-methyl-5-quinolinyl)-1-piperazinyl]propyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-[4-(7-fluoro-2-methylquinolin-5-yl)piperazin-1-yl]propyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-[4-(7-fluoro-2-methyl-5-quinolyl)piperazino]propyl]-4H-1,4-benzoxazin-3-one Formula: C25H27FN4O2 MolecularWeight: 434.505883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=CC(=C2C=C1)N3CCN(CC3)CCCC4=CC5=C(C=C4)OCC(=O)N5)F

Isomeric SMILES

CC1=NC2=CC(=CC(=C2C=C1)N3CCN(CC3)CCCC4=CC5=C(C=C4)OCC(=O)N5)F

InChI

InChI=1S/C25H27FN4O2/c1-17-4-6-20-21(27-17)14-19(26)15-23(20)30-11-9-29(10-12-30)8-2-3-18-5-7-24-22(13-18)28-25(31)16-32-24/h4-7,13-15H,2-3,8-12,16H2,1H3,(H,28,31)