1-(6-bromanyl-8-diethoxyphosphoryl-quinolin-2-yl)-3-methyl-butan-1-ol

Systemtic Name: 1-(6-bromanyl-8-diethoxyphosphoryl-quinolin-2-yl)-3-methyl-butan-1-ol Openeye Name: 1-(6-bromo-8-diethoxyphosphoryl-2-quinolyl)-3-methyl-butan-1-ol CAS Name: 1-(6-bromo-8-diethoxyphosphoryl-2-quinolinyl)-3-methyl-1-butanol IUPAC Name: 1-(6-bromo-8-diethoxyphosphorylquinolin-2-yl)-3-methylbutan-1-ol Traditional Name: 1-(6-bromo-8-diethoxyphosphoryl-2-quinolyl)-3-methyl-butan-1-ol Formula: C18H25BrNO4P MolecularWeight: 430.273161

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C2C(=CC(=C1)Br)C=CC(=N2)C(CC(C)C)O)OCC

Isomeric SMILES

CCOP(=O)(C1=C2C(=CC(=C1)Br)C=CC(=N2)C(CC(C)C)O)OCC

InChI

InChI=1S/C18H25BrNO4P/c1-5-23-25(22,24-6-2)17-11-14(19)10-13-7-8-15(20-18(13)17)16(21)9-12(3)4/h7-8,10-12,16,21H,5-6,9H2,1-4H3