4-diethoxyphosphoryl-2-(3-nitrophenyl)-N-(pyridin-3-ylmethyl)-1,3-oxazol-5-amine

Systemtic Name: 4-diethoxyphosphoryl-2-(3-nitrophenyl)-N-(pyridin-3-ylmethyl)-1,3-oxazol-5-amine Openeye Name: 4-diethoxyphosphoryl-2-(3-nitrophenyl)-N-(3-pyridylmethyl)oxazol-5-amine CAS Name: 4-diethoxyphosphoryl-2-(3-nitrophenyl)-N-(3-pyridinylmethyl)-5-oxazolamine IUPAC Name: 4-diethoxyphosphoryl-2-(3-nitrophenyl)-N-(pyridin-3-ylmethyl)-1,3-oxazol-5-amine Traditional Name: [4-diethoxyphosphoryl-2-(3-nitrophenyl)oxazol-5-yl]-(3-pyridylmethyl)amine Formula: C19H21N4O6P MolecularWeight: 432.367001

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C(OC(=N1)C2=CC(=CC=C2)[N+](=O)[O-])NCC3=CN=CC=C3)OCC

Isomeric SMILES

CCOP(=O)(C1=C(OC(=N1)C2=CC(=CC=C2)[N+](=O)[O-])NCC3=CN=CC=C3)OCC

InChI

InChI=1S/C19H21N4O6P/c1-3-27-30(26,28-4-2)19-18(21-13-14-7-6-10-20-12-14)29-17(22-19)15-8-5-9-16(11-15)23(24)25/h5-12,21H,3-4,13H2,1-2H3