1-[4-(3-morpholin-4-yl-4-nitro-phenyl)piperazin-1-yl]-2-(2-nitrophenoxy)ethanone

Systemtic Name: 1-[4-(3-morpholin-4-yl-4-nitro-phenyl)piperazin-1-yl]-2-(2-nitrophenoxy)ethanone Openeye Name: 1-[4-(3-morpholino-4-nitro-phenyl)piperazin-1-yl]-2-(2-nitrophenoxy)ethanone CAS Name: 1-[4-[3-(4-morpholinyl)-4-nitrophenyl]-1-piperazinyl]-2-(2-nitrophenoxy)ethanone IUPAC Name: 1-[4-(3-morpholin-4-yl-4-nitrophenyl)piperazin-1-yl]-2-(2-nitrophenoxy)ethanone Traditional Name: 1-[4-(3-morpholino-4-nitro-phenyl)piperazino]-2-(2-nitrophenoxy)ethanone Formula: C22H25N5O7 MolecularWeight: 471.4632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])N3CCOCC3)C(=O)COC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])N3CCOCC3)C(=O)COC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O7/c28-22(16-34-21-4-2-1-3-19(21)27(31)32)25-9-7-23(8-10-25)17-5-6-18(26(29)30)20(15-17)24-11-13-33-14-12-24/h1-6,15H,7-14,16H2