1-dimorpholin-4-ylphosphoryl-N'-(4-methoxyphenyl)-N-[(4-nitrophenyl)amino]methanimidamide

Systemtic Name: 1-dimorpholin-4-ylphosphoryl-N'-(4-methoxyphenyl)-N-[(4-nitrophenyl)amino]methanimidamide Openeye Name: 1-dimorpholinophosphoryl-N'-(4-methoxyphenyl)-N-(4-nitroanilino)formamidine CAS Name: 1-[bis(4-morpholinyl)phosphoryl]-N'-(4-methoxyphenyl)-N-(4-nitroanilino)methanimidamide IUPAC Name: 1-dimorpholin-4-ylphosphoryl-N'-(4-methoxyphenyl)-N-(4-nitroanilino)methanimidamide Traditional Name: 1-dimorpholinophosphoryl-N'-(4-methoxyphenyl)-N-(4-nitroanilino)formamidine Formula: C22H29N6O6P MolecularWeight: 504.476021

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=C(NNC2=CC=C(C=C2)[N+](=O)[O-])P(=O)(N3CCOCC3)N4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)N=C(NNC2=CC=C(C=C2)[N+](=O)[O-])P(=O)(N3CCOCC3)N4CCOCC4

InChI

InChI=1S/C22H29N6O6P/c1-32-21-8-4-18(5-9-21)23-22(25-24-19-2-6-20(7-3-19)28(29)30)35(31,26-10-14-33-15-11-26)27-12-16-34-17-13-27/h2-9,24H,10-17H2,1H3,(H,23,25)