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3-butyl-1-diethoxyphosphoryl-2-(4-fluorophenyl)-1H-isoquinoline

3-butyl-1-diethoxyphosphoryl-2-(4-fluorophenyl)-1H-isoquinoline

Systemtic Name:3-butyl-1-diethoxyphosphoryl-2-(4-fluorophenyl)-1H-isoquinoline
Openeye Name:3-butyl-1-diethoxyphosphoryl-2-(4-fluorophenyl)-1H-isoquinoline
CAS Name:3-butyl-1-diethoxyphosphoryl-2-(4-fluorophenyl)-1H-isoquinoline
IUPAC Name:3-butyl-1-diethoxyphosphoryl-2-(4-fluorophenyl)-1H-isoquinoline
Traditional Name:3-butyl-1-diethoxyphosphoryl-2-(4-fluorophenyl)-1H-isoquinoline
Formula: C23H29FNO3P
MolecularWeight: 417.453424
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC=CC=C2C(N1C3=CC=C(C=C3)F)P(=O)(OCC)OCC


Isomeric SMILES

CCCCC1=CC2=CC=CC=C2C(N1C3=CC=C(C=C3)F)P(=O)(OCC)OCC


InChI

InChI=1S/C23H29FNO3P/c1-4-7-11-21-17-18-10-8-9-12-22(18)23(29(26,27-5-2)28-6-3)25(21)20-15-13-19(24)14-16-20/h8-10,12-17,23H,4-7,11H2,1-3H3


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