1-[(3-bromophenyl)methylsulfonyl]-N-[3-(4-fluorophenyl)propyl]piperidine-4-carboxamide

Systemtic Name: 1-[(3-bromophenyl)methylsulfonyl]-N-[3-(4-fluorophenyl)propyl]piperidine-4-carboxamide Openeye Name: 1-[(3-bromophenyl)methylsulfonyl]-N-[3-(4-fluorophenyl)propyl]piperidine-4-carboxamide CAS Name: 1-[(3-bromophenyl)methylsulfonyl]-N-[3-(4-fluorophenyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3-bromophenyl)methylsulfonyl]-N-[3-(4-fluorophenyl)propyl]piperidine-4-carboxamide Traditional Name: 1-(3-bromobenzyl)sulfonyl-N-[3-(4-fluorophenyl)propyl]isonipecotamide Formula: C22H26BrFN2O3S MolecularWeight: 497.420843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCCC2=CC=C(C=C2)F)S(=O)(=O)CC3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCC1C(=O)NCCCC2=CC=C(C=C2)F)S(=O)(=O)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C22H26BrFN2O3S/c23-20-5-1-3-18(15-20)16-30(28,29)26-13-10-19(11-14-26)22(27)25-12-2-4-17-6-8-21(24)9-7-17/h1,3,5-9,15,19H,2,4,10-14,16H2,(H,25,27)