1-[(3-bromophenyl)methyl]-N-[5-chloranyl-2-(2-methoxyphenoxy)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-[(3-bromophenyl)methyl]-N-[5-chloranyl-2-(2-methoxyphenoxy)phenyl]piperidine-3-carboxamide Openeye Name: 1-[(3-bromophenyl)methyl]-N-[5-chloro-2-(2-methoxyphenoxy)phenyl]piperidine-3-carboxamide CAS Name: 1-[(3-bromophenyl)methyl]-N-[5-chloro-2-(2-methoxyphenoxy)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-[(3-bromophenyl)methyl]-N-[5-chloro-2-(2-methoxyphenoxy)phenyl]piperidine-3-carboxamide Traditional Name: 1-(3-bromobenzyl)-N-[5-chloro-2-(2-methoxyphenoxy)phenyl]nipecotamide 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)C3CCCN(C3)CC4=CC(=CC=C4)Br

Isomeric SMILES

COC1=CC=CC=C1OC2=C(C=C(C=C2)Cl)NC(=O)C3CCCN(C3)CC4=CC(=CC=C4)Br

InChI

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