1-[(4-bromophenyl)methyl]-N-[(E)-(2-fluorophenyl)methylideneamino]piperidine-4-carboxamide

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-[(E)-(2-fluorophenyl)methylideneamino]piperidine-4-carboxamide Openeye Name: 1-[(4-bromophenyl)methyl]-N-[(E)-(2-fluorophenyl)methyleneamino]piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)methyl]-N-[(E)-(2-fluorophenyl)methylideneamino]-4-piperidinecarboxamide IUPAC Name: 1-[(4-bromophenyl)methyl]-N-[(E)-(2-fluorophenyl)methylideneamino]piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzyl)-N-[(E)-(2-fluorobenzylidene)amino]isonipecotamide Formula: C20H21BrFN3O MolecularWeight: 418.302643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NN=CC2=CC=CC=C2F)CC3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCC1C(=O)N/N=C/C2=CC=CC=C2F)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H21BrFN3O/c21-18-7-5-15(6-8-18)14-25-11-9-16(10-12-25)20(26)24-23-13-17-3-1-2-4-19(17)22/h1-8,13,16H,9-12,14H2,(H,24,26)/b23-13+