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

Systemtic Name: 6-[2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]-1-oxidanyl-ethyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[1-hydroxy-2-[4-(2-methyl-5-quinolyl)piperazin-1-yl]ethyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[1-hydroxy-2-[4-(2-methyl-5-quinolinyl)-1-piperazinyl]ethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[1-hydroxy-2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[1-hydroxy-2-[4-(2-methyl-5-quinolyl)piperazino]ethyl]-4H-1,4-benzoxazin-3-one Formula: C24H26N4O3 MolecularWeight: 418.48824

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C24H26N4O3/c1-16-5-7-18-19(25-16)3-2-4-21(18)28-11-9-27(10-12-28)14-22(29)17-6-8-23-20(13-17)26-24(30)15-31-23/h2-8,13,22,29H,9-12,14-15H2,1H3,(H,26,30)