4-[1-diethoxyphosphoryl-2-(pyrimidin-2-ylamino)ethyl]-2-methoxy-6-methyl-phenol

Systemtic Name: 4-[1-diethoxyphosphoryl-2-(pyrimidin-2-ylamino)ethyl]-2-methoxy-6-methyl-phenol Openeye Name: 4-[1-diethoxyphosphoryl-2-(pyrimidin-2-ylamino)ethyl]-2-methoxy-6-methyl-phenol CAS Name: 4-[1-diethoxyphosphoryl-2-(2-pyrimidinylamino)ethyl]-2-methoxy-6-methylphenol IUPAC Name: 4-[1-diethoxyphosphoryl-2-(pyrimidin-2-ylamino)ethyl]-2-methoxy-6-methylphenol Traditional Name: 4-[1-diethoxyphosphoryl-2-(2-pyrimidylamino)ethyl]-2-methoxy-6-methyl-phenol Formula: C18H26N3O5P MolecularWeight: 395.389901

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CNC1=NC=CC=N1)C2=CC(=C(C(=C2)OC)O)C)OCC

Isomeric SMILES

CCOP(=O)(C(CNC1=NC=CC=N1)C2=CC(=C(C(=C2)OC)O)C)OCC

InChI

InChI=1S/C18H26N3O5P/c1-5-25-27(23,26-6-2)16(12-21-18-19-8-7-9-20-18)14-10-13(3)17(22)15(11-14)24-4/h7-11,16,22H,5-6,12H2,1-4H3,(H,19,20,21)