[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-(4-nitro-3-oxidanyl-phenyl)methanone

Systemtic Name: [4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-(4-nitro-3-oxidanyl-phenyl)methanone Openeye Name: [4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]-(3-hydroxy-4-nitro-phenyl)methanone CAS Name: [4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]-(3-hydroxy-4-nitrophenyl)methanone IUPAC Name: [4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-(3-hydroxy-4-nitrophenyl)methanone Traditional Name: [4-(3-fluoro-4-methoxy-benzyl)piperazino]-(3-hydroxy-4-nitro-phenyl)methanone Formula: C19H20FN3O5 MolecularWeight: 389.377603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)[N+](=O)[O-])O)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)[N+](=O)[O-])O)F

InChI

InChI=1S/C19H20FN3O5/c1-28-18-5-2-13(10-15(18)20)12-21-6-8-22(9-7-21)19(25)14-3-4-16(23(26)27)17(24)11-14/h2-5,10-11,24H,6-9,12H2,1H3