N-[2-diethoxyphosphoryl-3-(3,6-dihydro-2H-pyran-5-yl)-3-oxidanyl-propyl]pyridine-3-carboxamide

Systemtic Name: N-[2-diethoxyphosphoryl-3-(3,6-dihydro-2H-pyran-5-yl)-3-oxidanyl-propyl]pyridine-3-carboxamide Openeye Name: N-[2-diethoxyphosphoryl-3-(3,6-dihydro-2H-pyran-5-yl)-3-hydroxy-propyl]pyridine-3-carboxamide CAS Name: N-[2-diethoxyphosphoryl-3-(3,6-dihydro-2H-pyran-5-yl)-3-hydroxypropyl]-3-pyridinecarboxamide IUPAC Name: N-[2-diethoxyphosphoryl-3-(3,6-dihydro-2H-pyran-5-yl)-3-hydroxypropyl]pyridine-3-carboxamide Traditional Name: N-[2-diethoxyphosphoryl-3-(3,6-dihydro-2H-pyran-5-yl)-3-hydroxy-propyl]nicotinamide Formula: C18H27N2O6P MolecularWeight: 398.390541

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CNC(=O)C1=CN=CC=C1)C(C2=CCCOC2)O)OCC

Isomeric SMILES

CCOP(=O)(C(CNC(=O)C1=CN=CC=C1)C(C2=CCCOC2)O)OCC

InChI

InChI=1S/C18H27N2O6P/c1-3-25-27(23,26-4-2)16(17(21)15-8-6-10-24-13-15)12-20-18(22)14-7-5-9-19-11-14/h5,7-9,11,16-17,21H,3-4,6,10,12-13H2,1-2H3,(H,20,22)