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

Systemtic Name: 2-(2-chloranylphenoxy)-1-[4-(3-morpholin-4-yl-4-nitro-phenyl)piperazin-1-yl]ethanone Openeye Name: 2-(2-chlorophenoxy)-1-[4-(3-morpholino-4-nitro-phenyl)piperazin-1-yl]ethanone CAS Name: 2-(2-chlorophenoxy)-1-[4-[3-(4-morpholinyl)-4-nitrophenyl]-1-piperazinyl]ethanone IUPAC Name: 2-(2-chlorophenoxy)-1-[4-(3-morpholin-4-yl-4-nitrophenyl)piperazin-1-yl]ethanone Traditional Name: 2-(2-chlorophenoxy)-1-[4-(3-morpholino-4-nitro-phenyl)piperazino]ethanone Formula: C22H25ClN4O5 MolecularWeight: 460.9107

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])N3CCOCC3)C(=O)COC4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])N3CCOCC3)C(=O)COC4=CC=CC=C4Cl

InChI

InChI=1S/C22H25ClN4O5/c23-18-3-1-2-4-21(18)32-16-22(28)26-9-7-24(8-10-26)17-5-6-19(27(29)30)20(15-17)25-11-13-31-14-12-25/h1-6,15H,7-14,16H2