(5-bromanyl-2-fluoranyl-phenyl)-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (5-bromanyl-2-fluoranyl-phenyl)-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]methanone Openeye Name: (5-bromo-2-fluoro-phenyl)-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]methanone CAS Name: (5-bromo-2-fluorophenyl)-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (5-bromo-2-fluorophenyl)-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (5-bromo-2-fluoro-phenyl)-[4-(2,5-dimethoxybenzyl)piperazino]methanone Formula: C20H22BrFN2O3 MolecularWeight: 437.302683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)C3=C(C=CC(=C3)Br)F

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C20H22BrFN2O3/c1-26-16-4-6-19(27-2)14(11-16)13-23-7-9-24(10-8-23)20(25)17-12-15(21)3-5-18(17)22/h3-6,11-12H,7-10,13H2,1-2H3