1-(4-bromophenyl)carbonyl-N-[[2-(dimethylaminomethyl)phenyl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)carbonyl-N-[[2-(dimethylaminomethyl)phenyl]methyl]piperidine-4-carboxamide Openeye Name: 1-(4-bromobenzoyl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)-oxomethyl]-N-[[2-(dimethylaminomethyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-bromobenzoyl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzoyl)-N-[2-(dimethylaminomethyl)benzyl]isonipecotamide Formula: C23H28BrN3O2 MolecularWeight: 458.39132

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1CNC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CN(C)CC1=CC=CC=C1CNC(=O)C2CCN(CC2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C23H28BrN3O2/c1-26(2)16-20-6-4-3-5-19(20)15-25-22(28)17-11-13-27(14-12-17)23(29)18-7-9-21(24)10-8-18/h3-10,17H,11-16H2,1-2H3,(H,25,28)