6-[1-fluoranyl-2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[1-fluoranyl-2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[1-fluoro-2-[4-(2-methyl-5-quinolyl)piperazin-1-yl]ethyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[1-fluoro-2-[4-(2-methyl-5-quinolinyl)-1-piperazinyl]ethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[1-fluoro-2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[1-fluoro-2-[4-(2-methyl-5-quinolyl)piperazino]ethyl]-4H-1,4-benzoxazin-3-one Formula: C24H25FN4O2 MolecularWeight: 420.479303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC=C2)N3CCN(CC3)CC(C4=CC5=C(C=C4)OCC(=O)N5)F

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC=C2)N3CCN(CC3)CC(C4=CC5=C(C=C4)OCC(=O)N5)F

InChI

InChI=1S/C24H25FN4O2/c1-16-5-7-18-20(26-16)3-2-4-22(18)29-11-9-28(10-12-29)14-19(25)17-6-8-23-21(13-17)27-24(30)15-31-23/h2-8,13,19H,9-12,14-15H2,1H3,(H,27,30)