3-butyl-1-diethoxyphosphoryl-2-phenyl-1H-isoquinoline

Systemtic Name: 3-butyl-1-diethoxyphosphoryl-2-phenyl-1H-isoquinoline Openeye Name: 3-butyl-1-diethoxyphosphoryl-2-phenyl-1H-isoquinoline CAS Name: 3-butyl-1-diethoxyphosphoryl-2-phenyl-1H-isoquinoline IUPAC Name: 3-butyl-1-diethoxyphosphoryl-2-phenyl-1H-isoquinoline Traditional Name: 3-butyl-1-diethoxyphosphoryl-2-phenyl-1H-isoquinoline Formula: C23H30NO3P MolecularWeight: 399.462961

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30NO3P/c1-4-7-14-21-18-19-13-11-12-17-22(19)23(28(25,26-5-2)27-6-3)24(21)20-15-9-8-10-16-20/h8-13,15-18,23H,4-7,14H2,1-3H3