6-[[1-[2-(7-iodanyl-2-methyl-quinolin-5-yl)oxyethyl]piperidin-4-yl]methyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[[1-[2-(7-iodanyl-2-methyl-quinolin-5-yl)oxyethyl]piperidin-4-yl]methyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[[1-[2-[(7-iodo-2-methyl-5-quinolyl)oxy]ethyl]-4-piperidyl]methyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[[1-[2-[(7-iodo-2-methyl-5-quinolinyl)oxy]ethyl]-4-piperidinyl]methyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[[1-[2-(7-iodo-2-methylquinolin-5-yl)oxyethyl]piperidin-4-yl]methyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[[1-[2-[(7-iodo-2-methyl-5-quinolyl)oxy]ethyl]-4-piperidyl]methyl]-4H-1,4-benzoxazin-3-one Formula: C26H28IN3O3 MolecularWeight: 557.42329

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=CC(=C2C=C1)OCCN3CCC(CC3)CC4=CC5=C(C=C4)OCC(=O)N5)I

Isomeric SMILES

CC1=NC2=CC(=CC(=C2C=C1)OCCN3CCC(CC3)CC4=CC5=C(C=C4)OCC(=O)N5)I

InChI

InChI=1S/C26H28IN3O3/c1-17-2-4-21-22(28-17)14-20(27)15-25(21)32-11-10-30-8-6-18(7-9-30)12-19-3-5-24-23(13-19)29-26(31)16-33-24/h2-5,13-15,18H,6-12,16H2,1H3,(H,29,31)