4-[diethoxyphosphoryl-(4-pyridin-2-ylpiperazin-1-yl)methyl]phenol

Systemtic Name: 4-[diethoxyphosphoryl-(4-pyridin-2-ylpiperazin-1-yl)methyl]phenol Openeye Name: 4-[diethoxyphosphoryl-[4-(2-pyridyl)piperazin-1-yl]methyl]phenol CAS Name: 4-[diethoxyphosphoryl-[4-(2-pyridinyl)-1-piperazinyl]methyl]phenol IUPAC Name: 4-[diethoxyphosphoryl-(4-pyridin-2-ylpiperazin-1-yl)methyl]phenol Traditional Name: 4-[diethoxyphosphoryl-[4-(2-pyridyl)piperazino]methyl]phenol Formula: C20H28N3O4P MolecularWeight: 405.427781

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=CC=C(C=C1)O)N2CCN(CC2)C3=CC=CC=N3)OCC

Isomeric SMILES

CCOP(=O)(C(C1=CC=C(C=C1)O)N2CCN(CC2)C3=CC=CC=N3)OCC

InChI

InChI=1S/C20H28N3O4P/c1-3-26-28(25,27-4-2)20(17-8-10-18(24)11-9-17)23-15-13-22(14-16-23)19-7-5-6-12-21-19/h5-12,20,24H,3-4,13-16H2,1-2H3