(4-fluoranyl-3-nitro-phenyl)-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (4-fluoranyl-3-nitro-phenyl)-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (4-fluoro-3-nitro-phenyl)-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (4-fluoro-3-nitrophenyl)-[4-[(4-methoxyphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (4-fluoro-3-nitrophenyl)-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (4-fluoro-3-nitro-phenyl)-(4-p-anisylpiperazin-4-ium-1-yl)methanone Formula: C19H21FN3O4+ MolecularWeight: 374.386143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C19H20FN3O4/c1-27-16-5-2-14(3-6-16)13-21-8-10-22(11-9-21)19(24)15-4-7-17(20)18(12-15)23(25)26/h2-7,12H,8-11,13H2,1H3/p+1