3-(3-fluoranyl-4-methoxy-phenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(3-fluoranyl-4-methoxy-phenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(3-fluoro-4-methoxy-phenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one CAS Name: 3-(3-fluoro-4-methoxyphenyl)-1-[4-(4-nitrophenyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(3-fluoro-4-methoxyphenyl)-1-[4-(4-nitrophenyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(3-fluoro-4-methoxy-phenyl)-1-[4-(4-nitrophenyl)piperazino]propan-1-one Formula: C20H22FN3O4 MolecularWeight: 387.404783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22FN3O4/c1-28-19-8-2-15(14-18(19)21)3-9-20(25)23-12-10-22(11-13-23)16-4-6-17(7-5-16)24(26)27/h2,4-8,14H,3,9-13H2,1H3