N-(4-bromanyl-2-fluoranyl-phenyl)-1-[(3-ethoxyphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-1-[(3-ethoxyphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-1-[(3-ethoxyphenyl)methyl]piperidine-4-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-1-[(3-ethoxyphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-1-[(3-ethoxyphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-1-(3-ethoxybenzyl)isonipecotamide Formula: C21H24BrFN2O2 MolecularWeight: 435.329863

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CCOC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C21H24BrFN2O2/c1-2-27-18-5-3-4-15(12-18)14-25-10-8-16(9-11-25)21(26)24-20-7-6-17(22)13-19(20)23/h3-7,12-13,16H,2,8-11,14H2,1H3,(H,24,26)