4-dimethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-N-(pyridin-3-ylmethyl)-1,3-oxazol-5-amine

Systemtic Name: 4-dimethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-N-(pyridin-3-ylmethyl)-1,3-oxazol-5-amine Openeye Name: 4-dimethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-N-(3-pyridylmethyl)oxazol-5-amine CAS Name: 4-dimethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-N-(3-pyridinylmethyl)-5-oxazolamine IUPAC Name: 4-dimethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-N-(pyridin-3-ylmethyl)-1,3-oxazol-5-amine Traditional Name: [4-dimethoxyphosphoryl-2-(4-nitrobenzyl)oxazol-5-yl]-(3-pyridylmethyl)amine Formula: C18H19N4O6P MolecularWeight: 418.340421

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(C1=C(OC(=N1)CC2=CC=C(C=C2)[N+](=O)[O-])NCC3=CN=CC=C3)OC

Isomeric SMILES

COP(=O)(C1=C(OC(=N1)CC2=CC=C(C=C2)[N+](=O)[O-])NCC3=CN=CC=C3)OC

InChI

InChI=1S/C18H19N4O6P/c1-26-29(25,27-2)18-17(20-12-14-4-3-9-19-11-14)28-16(21-18)10-13-5-7-15(8-6-13)22(23)24/h3-9,11,20H,10,12H2,1-2H3