1-(4-bromophenyl)sulfonyl-N-[4-(cyanomethoxy)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-[4-(cyanomethoxy)phenyl]piperidine-3-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-[4-(cyanomethoxy)phenyl]piperidine-3-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-[4-(cyanomethoxy)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-[4-(cyanomethoxy)phenyl]piperidine-3-carboxamide Traditional Name: 1-brosyl-N-[4-(cyanomethoxy)phenyl]nipecotamide Formula: C20H20BrN3O4S MolecularWeight: 478.3595

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20BrN3O4S/c21-16-3-9-19(10-4-16)29(26,27)24-12-1-2-15(14-24)20(25)23-17-5-7-18(8-6-17)28-13-11-22/h3-10,15H,1-2,12-14H2,(H,23,25)