1-[(4-bromophenyl)methyl]-N-[5-chloranyl-2-(2-methoxyphenoxy)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-[(4-bromophenyl)methyl]-N-[5-chloranyl-2-(2-methoxyphenoxy)phenyl]piperidine-4-carboxamide Openeye Name: 1-[(4-bromophenyl)methyl]-N-[5-chloro-2-(2-methoxyphenoxy)phenyl]piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)methyl]-N-[5-chloro-2-(2-methoxyphenoxy)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(4-bromophenyl)methyl]-N-[5-chloro-2-(2-methoxyphenoxy)phenyl]piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzyl)-N-[5-chloro-2-(2-methoxyphenoxy)phenyl]isonipecotamide Formula: C26H26BrClN2O3 MolecularWeight: 529.85324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2=C(C=C(C=C2)Cl)NC(=O)C3CCN(CC3)CC4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=CC=C1OC2=C(C=C(C=C2)Cl)NC(=O)C3CCN(CC3)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C26H26BrClN2O3/c1-32-24-4-2-3-5-25(24)33-23-11-10-21(28)16-22(23)29-26(31)19-12-14-30(15-13-19)17-18-6-8-20(27)9-7-18/h2-11,16,19H,12-15,17H2,1H3,(H,29,31)