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

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-1-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-1-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-1-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-1-m-anisyl-isonipecotamide Formula: C20H22BrFN2O2 MolecularWeight: 421.303283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

COC1=CC=CC(=C1)CN2CCC(CC2)C(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C20H22BrFN2O2/c1-26-17-4-2-3-14(11-17)13-24-9-7-15(8-10-24)20(25)23-19-6-5-16(21)12-18(19)22/h2-6,11-12,15H,7-10,13H2,1H3,(H,23,25)