1-[(4-bromophenyl)methyl]-N-[4-(cyanomethyl)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-[4-(cyanomethyl)phenyl]piperidine-3-carboxamide Openeye Name: 1-[(4-bromophenyl)methyl]-N-[4-(cyanomethyl)phenyl]piperidine-3-carboxamide CAS Name: 1-[(4-bromophenyl)methyl]-N-[4-(cyanomethyl)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-[(4-bromophenyl)methyl]-N-[4-(cyanomethyl)phenyl]piperidine-3-carboxamide Traditional Name: 1-(4-bromobenzyl)-N-[4-(cyanomethyl)phenyl]nipecotamide Formula: C21H22BrN3O MolecularWeight: 412.32288

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=C(C=C2)Br)C(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

C1CC(CN(C1)CC2=CC=C(C=C2)Br)C(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C21H22BrN3O/c22-19-7-3-17(4-8-19)14-25-13-1-2-18(15-25)21(26)24-20-9-5-16(6-10-20)11-12-23/h3-10,18H,1-2,11,13-15H2,(H,24,26)