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

Systemtic Name: (4-ethoxy-3-nitro-phenyl)-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone Openeye Name: (4-ethoxy-3-nitro-phenyl)-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone CAS Name: (4-ethoxy-3-nitrophenyl)-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (4-ethoxy-3-nitrophenyl)-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (4-ethoxy-3-nitro-phenyl)-[4-(3-fluoro-4-methoxy-benzyl)piperazino]methanone Formula: C21H24FN3O5 MolecularWeight: 417.430763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC(=C(C=C3)OC)F)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC(=C(C=C3)OC)F)[N+](=O)[O-]

InChI

InChI=1S/C21H24FN3O5/c1-3-30-20-7-5-16(13-18(20)25(27)28)21(26)24-10-8-23(9-11-24)14-15-4-6-19(29-2)17(22)12-15/h4-7,12-13H,3,8-11,14H2,1-2H3