[4-(4-fluorophenyl)piperazin-1-yl]-(3,4,5-trimethoxy-2-nitro-phenyl)methanone

Systemtic Name: [4-(4-fluorophenyl)piperazin-1-yl]-(3,4,5-trimethoxy-2-nitro-phenyl)methanone Openeye Name: [4-(4-fluorophenyl)piperazin-1-yl]-(3,4,5-trimethoxy-2-nitro-phenyl)methanone CAS Name: [4-(4-fluorophenyl)-1-piperazinyl]-(3,4,5-trimethoxy-2-nitrophenyl)methanone IUPAC Name: [4-(4-fluorophenyl)piperazin-1-yl]-(3,4,5-trimethoxy-2-nitrophenyl)methanone Traditional Name: [4-(4-fluorophenyl)piperazino]-(3,4,5-trimethoxy-2-nitro-phenyl)methanone Formula: C20H22FN3O6 MolecularWeight: 419.403583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22FN3O6/c1-28-16-12-15(17(24(26)27)19(30-3)18(16)29-2)20(25)23-10-8-22(9-11-23)14-6-4-13(21)5-7-14/h4-7,12H,8-11H2,1-3H3