1-[(3-bromophenyl)methylsulfonyl]-N-(3-morpholin-4-ylpropyl)piperidine-4-carboxamide

Systemtic Name: 1-[(3-bromophenyl)methylsulfonyl]-N-(3-morpholin-4-ylpropyl)piperidine-4-carboxamide Openeye Name: 1-[(3-bromophenyl)methylsulfonyl]-N-(3-morpholinopropyl)piperidine-4-carboxamide CAS Name: 1-[(3-bromophenyl)methylsulfonyl]-N-[3-(4-morpholinyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3-bromophenyl)methylsulfonyl]-N-(3-morpholin-4-ylpropyl)piperidine-4-carboxamide Traditional Name: 1-(3-bromobenzyl)sulfonyl-N-(3-morpholinopropyl)isonipecotamide Formula: C20H30BrN3O4S MolecularWeight: 488.4389

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCCN2CCOCC2)S(=O)(=O)CC3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCC1C(=O)NCCCN2CCOCC2)S(=O)(=O)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C20H30BrN3O4S/c21-19-4-1-3-17(15-19)16-29(26,27)24-9-5-18(6-10-24)20(25)22-7-2-8-23-11-13-28-14-12-23/h1,3-4,15,18H,2,5-14,16H2,(H,22,25)