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

Systemtic Name: 4-diethoxyphosphoryl-N-[(4-methylphenyl)methyl]-2-(3-nitrophenyl)-1,3-oxazol-5-amine Openeye Name: 4-diethoxyphosphoryl-2-(3-nitrophenyl)-N-(p-tolylmethyl)oxazol-5-amine CAS Name: 4-diethoxyphosphoryl-N-[(4-methylphenyl)methyl]-2-(3-nitrophenyl)-5-oxazolamine IUPAC Name: 4-diethoxyphosphoryl-N-[(4-methylphenyl)methyl]-2-(3-nitrophenyl)-1,3-oxazol-5-amine Traditional Name: [4-diethoxyphosphoryl-2-(3-nitrophenyl)oxazol-5-yl]-(4-methylbenzyl)amine Formula: C21H24N3O6P MolecularWeight: 445.405521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N3O6P/c1-4-28-31(27,29-5-2)21-20(22-14-16-11-9-15(3)10-12-16)30-19(23-21)17-7-6-8-18(13-17)24(25)26/h6-13,22H,4-5,14H2,1-3H3