(2,6-dimethoxyphenyl)-[4-(3-morpholin-4-yl-4-nitro-phenyl)piperazin-1-yl]methanone

Systemtic Name: (2,6-dimethoxyphenyl)-[4-(3-morpholin-4-yl-4-nitro-phenyl)piperazin-1-yl]methanone Openeye Name: (2,6-dimethoxyphenyl)-[4-(3-morpholino-4-nitro-phenyl)piperazin-1-yl]methanone CAS Name: (2,6-dimethoxyphenyl)-[4-[3-(4-morpholinyl)-4-nitrophenyl]-1-piperazinyl]methanone IUPAC Name: (2,6-dimethoxyphenyl)-[4-(3-morpholin-4-yl-4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (2,6-dimethoxyphenyl)-[4-(3-morpholino-4-nitro-phenyl)piperazino]methanone Formula: C23H28N4O6 MolecularWeight: 456.49162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C23H28N4O6/c1-31-20-4-3-5-21(32-2)22(20)23(28)26-10-8-24(9-11-26)17-6-7-18(27(29)30)19(16-17)25-12-14-33-15-13-25/h3-7,16H,8-15H2,1-2H3