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

Systemtic Name: 3-butyl-1-diethoxyphosphoryl-2-(4-methoxyphenyl)-1H-isoquinoline Openeye Name: 3-butyl-1-diethoxyphosphoryl-2-(4-methoxyphenyl)-1H-isoquinoline CAS Name: 3-butyl-1-diethoxyphosphoryl-2-(4-methoxyphenyl)-1H-isoquinoline IUPAC Name: 3-butyl-1-diethoxyphosphoryl-2-(4-methoxyphenyl)-1H-isoquinoline Traditional Name: 3-butyl-1-diethoxyphosphoryl-2-(4-methoxyphenyl)-1H-isoquinoline Formula: C24H32NO4P MolecularWeight: 429.488941

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32NO4P/c1-5-8-12-21-18-19-11-9-10-13-23(19)24(30(26,28-6-2)29-7-3)25(21)20-14-16-22(27-4)17-15-20/h9-11,13-18,24H,5-8,12H2,1-4H3