N-(4-bromanyl-2-fluoranyl-phenyl)-2-[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]acetamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-[4-[(2-ethoxyphenyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-[4-[(2-ethoxyphenyl)methyl]piperazin-1-yl]acetamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-[4-(2-ethoxybenzyl)piperazino]acetamide Formula: C21H25BrFN3O2 MolecularWeight: 450.344503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CCOC1=CC=CC=C1CN2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C21H25BrFN3O2/c1-2-28-20-6-4-3-5-16(20)14-25-9-11-26(12-10-25)15-21(27)24-19-8-7-17(22)13-18(19)23/h3-8,13H,2,9-12,14-15H2,1H3,(H,24,27)