2-[4-(2-diethoxyphosphorylethanoyl)piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-(2-diethoxyphosphorylethanoyl)piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-(2-diethoxyphosphorylacetyl)piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-(2-diethoxyphosphoryl-1-oxoethyl)-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-(2-diethoxyphosphorylacetyl)piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-(2-diethoxyphosphorylacetyl)piperazino]nicotinonitrile Formula: C16H23N4O4P MolecularWeight: 366.351981

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC(=O)N1CCN(CC1)C2=C(C=CC=N2)C#N)OCC

Isomeric SMILES

CCOP(=O)(CC(=O)N1CCN(CC1)C2=C(C=CC=N2)C#N)OCC

InChI

InChI=1S/C16H23N4O4P/c1-3-23-25(22,24-4-2)13-15(21)19-8-10-20(11-9-19)16-14(12-17)6-5-7-18-16/h5-7H,3-4,8-11,13H2,1-2H3