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

Systemtic Name: 4-dimethoxyphosphoryl-2-(4-nitrophenyl)-N-(pyridin-3-ylmethyl)-1,3-oxazol-5-amine Openeye Name: 4-dimethoxyphosphoryl-2-(4-nitrophenyl)-N-(3-pyridylmethyl)oxazol-5-amine CAS Name: 4-dimethoxyphosphoryl-2-(4-nitrophenyl)-N-(3-pyridinylmethyl)-5-oxazolamine IUPAC Name: 4-dimethoxyphosphoryl-2-(4-nitrophenyl)-N-(pyridin-3-ylmethyl)-1,3-oxazol-5-amine Traditional Name: [4-dimethoxyphosphoryl-2-(4-nitrophenyl)oxazol-5-yl]-(3-pyridylmethyl)amine Formula: C17H17N4O6P MolecularWeight: 404.313841

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N4O6P/c1-25-28(24,26-2)17-16(19-11-12-4-3-9-18-10-12)27-15(20-17)13-5-7-14(8-6-13)21(22)23/h3-10,19H,11H2,1-2H3