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

Systemtic Name: 2-(4-chlorophenyl)-1-[4-(3-morpholin-4-yl-4-nitro-phenyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-chlorophenyl)-1-[4-(3-morpholino-4-nitro-phenyl)piperazin-1-yl]ethanone CAS Name: 2-(4-chlorophenyl)-1-[4-[3-(4-morpholinyl)-4-nitrophenyl]-1-piperazinyl]ethanone IUPAC Name: 2-(4-chlorophenyl)-1-[4-(3-morpholin-4-yl-4-nitrophenyl)piperazin-1-yl]ethanone Traditional Name: 2-(4-chlorophenyl)-1-[4-(3-morpholino-4-nitro-phenyl)piperazino]ethanone Formula: C22H25ClN4O4 MolecularWeight: 444.9113

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])N3CCOCC3)C(=O)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])N3CCOCC3)C(=O)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H25ClN4O4/c23-18-3-1-17(2-4-18)15-22(28)26-9-7-24(8-10-26)19-5-6-20(27(29)30)21(16-19)25-11-13-31-14-12-25/h1-6,16H,7-15H2