8-[3-[4-(7-fluoranyl-2-methyl-quinolin-5-yl)piperazin-1-yl]propyl]-4-methyl-1,4-benzoxazin-3-one

Systemtic Name: 8-[3-[4-(7-fluoranyl-2-methyl-quinolin-5-yl)piperazin-1-yl]propyl]-4-methyl-1,4-benzoxazin-3-one Openeye Name: 8-[3-[4-(7-fluoro-2-methyl-5-quinolyl)piperazin-1-yl]propyl]-4-methyl-1,4-benzoxazin-3-one CAS Name: 8-[3-[4-(7-fluoro-2-methyl-5-quinolinyl)-1-piperazinyl]propyl]-4-methyl-1,4-benzoxazin-3-one IUPAC Name: 8-[3-[4-(7-fluoro-2-methylquinolin-5-yl)piperazin-1-yl]propyl]-4-methyl-1,4-benzoxazin-3-one Traditional Name: 8-[3-[4-(7-fluoro-2-methyl-5-quinolyl)piperazino]propyl]-4-methyl-1,4-benzoxazin-3-one Formula: C26H29FN4O2 MolecularWeight: 448.532463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=CC(=C2C=C1)N3CCN(CC3)CCCC4=C5C(=CC=C4)N(C(=O)CO5)C)F

Isomeric SMILES

CC1=NC2=CC(=CC(=C2C=C1)N3CCN(CC3)CCCC4=C5C(=CC=C4)N(C(=O)CO5)C)F

InChI

InChI=1S/C26H29FN4O2/c1-18-8-9-21-22(28-18)15-20(27)16-24(21)31-13-11-30(12-14-31)10-4-6-19-5-3-7-23-26(19)33-17-25(32)29(23)2/h3,5,7-9,15-16H,4,6,10-14,17H2,1-2H3