4-diethoxyphosphoryl-N-[(4-fluorophenyl)methyl]-2-[(4-nitrophenyl)methyl]-1,3-oxazol-5-amine

Systemtic Name: 4-diethoxyphosphoryl-N-[(4-fluorophenyl)methyl]-2-[(4-nitrophenyl)methyl]-1,3-oxazol-5-amine Openeye Name: 4-diethoxyphosphoryl-N-[(4-fluorophenyl)methyl]-2-[(4-nitrophenyl)methyl]oxazol-5-amine CAS Name: 4-diethoxyphosphoryl-N-[(4-fluorophenyl)methyl]-2-[(4-nitrophenyl)methyl]-5-oxazolamine IUPAC Name: 4-diethoxyphosphoryl-N-[(4-fluorophenyl)methyl]-2-[(4-nitrophenyl)methyl]-1,3-oxazol-5-amine Traditional Name: [4-diethoxyphosphoryl-2-(4-nitrobenzyl)oxazol-5-yl]-(4-fluorobenzyl)amine Formula: C21H23FN3O6P MolecularWeight: 463.395984

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C(OC(=N1)CC2=CC=C(C=C2)[N+](=O)[O-])NCC3=CC=C(C=C3)F)OCC

Isomeric SMILES

CCOP(=O)(C1=C(OC(=N1)CC2=CC=C(C=C2)[N+](=O)[O-])NCC3=CC=C(C=C3)F)OCC

InChI

InChI=1S/C21H23FN3O6P/c1-3-29-32(28,30-4-2)21-20(23-14-16-5-9-17(22)10-6-16)31-19(24-21)13-15-7-11-18(12-8-15)25(26)27/h5-12,23H,3-4,13-14H2,1-2H3