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

Systemtic Name: 6-[[4-[3-(2-methylquinolin-5-yl)oxypropyl]piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[[4-[3-[(2-methyl-5-quinolyl)oxy]propyl]piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[[4-[3-[(2-methyl-5-quinolinyl)oxy]propyl]-1-piperazinyl]methyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[[4-[3-(2-methylquinolin-5-yl)oxypropyl]piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[[4-[3-[(2-methyl-5-quinolyl)oxy]propyl]piperazino]methyl]-4H-1,4-benzoxazin-3-one Formula: C26H30N4O3 MolecularWeight: 446.5414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC=C2)OCCCN3CCN(CC3)CC4=CC5=C(C=C4)OCC(=O)N5

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC=C2)OCCCN3CCN(CC3)CC4=CC5=C(C=C4)OCC(=O)N5

InChI

InChI=1S/C26H30N4O3/c1-19-6-8-21-22(27-19)4-2-5-24(21)32-15-3-10-29-11-13-30(14-12-29)17-20-7-9-25-23(16-20)28-26(31)18-33-25/h2,4-9,16H,3,10-15,17-18H2,1H3,(H,28,31)